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92891-35-5 | Thiourea, diethyl(3,4,5-trimethyl-2(3H)-thiazolylidene)-
CAS No: 92891-35-5 Catalog No: AG00686D MDL No:
Product Description
Catalog Number:
AG00686D
Chemical Name:
Thiourea, diethyl(3,4,5-trimethyl-2(3H)-thiazolylidene)-
CAS Number:
92891-35-5
Molecular Formula:
C11H19N3S2
Molecular Weight:
257.4187
IUPAC Name:
1,1-diethyl-3-(3,4,5-trimethyl-1,3-thiazol-2-ylidene)thiourea
InChI:
InChI=1S/C11H19N3S2/c1-6-14(7-2)10(15)12-11-13(5)8(3)9(4)16-11/h6-7H2,1-5H3
InChI Key:
XJZFDLNAZFLPIO-UHFFFAOYSA-N
SMILES:
CCN(C(=S)N=c1sc(c(n1C)C)C)CC
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.102g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.414g/mol
Monoisotopic Mass:
257.102g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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