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90293-56-4

90293-56-4 | 2,12-BIS(1-(METHOXYIMINO)ETHYL)-5,9-DIOXO-N,N,N',N',6,8-HEXAMETHYL-4,10-DIOXA-7-THIA -3,6,8,11- TETRAAZATRIDECA-2,11-DIENEDIAMIDE

CAS No: 90293-56-4 Catalog No: AG006GLX MDL No:

Product Description

Catalog Number:
AG006GLX
Chemical Name:
2,12-BIS(1-(METHOXYIMINO)ETHYL)-5,9-DIOXO-N,N,N',N',6,8-HEXAMETHYL-4,10-DIOXA-7-THIA -3,6,8,11- TETRAAZATRIDECA-2,11-DIENEDIAMIDE
CAS Number:
90293-56-4
Molecular Formula:
C18H30N8O8S
Molecular Weight:
518.5446
IUPAC Name:
[[1-(dimethylamino)-3-methoxyimino-1-oxobutan-2-ylidene]amino] N-[[[1-(dimethylamino)-3-methoxyimino-1-oxobutan-2-ylidene]amino]oxycarbonyl-methylamino]sulfanyl-N-methylcarbamate
InChI:
InChI=1S/C18H30N8O8S/c1-11(19-31-9)13(15(27)23(3)4)21-33-17(29)25(7)35-26(8)18(30)34-22-14(12(2)20-32-10)16(28)24(5)6/h1-10H3
InChI Key:
QQVATBDKGAQJDZ-UHFFFAOYSA-N
SMILES:
CON=C(C(=NOC(=O)N(SN(C(=O)ON=C(C(=O)N(C)C)C(=NOC)C)C)C)C(=O)N(C)C)C

Properties

Complexity:
844  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
518.191g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
13  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
518.546g/mol
Monoisotopic Mass:
518.191g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
193A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
4  
XLogP3:
1.3  

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