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353254-69-0 | PROPYL [(2-THIOXOBENZO[D]THIAZOL-3(2H)-YL)METHYL] CYANOCARBONIMIDODITHIOATE
CAS No: 353254-69-0 Catalog No: AG00C8S7 MDL No:
Product Description
Catalog Number:
AG00C8S7
Chemical Name:
PROPYL [(2-THIOXOBENZO[D]THIAZOL-3(2H)-YL)METHYL] CYANOCARBONIMIDODITHIOATE
CAS Number:
353254-69-0
IUPAC Name:
[propylsulfanyl-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylsulfanyl]methylidene]cyanamide
InChI:
InChI=1S/C13H13N3S4/c1-2-7-18-12(15-8-14)19-9-16-10-5-3-4-6-11(10)20-13(16)17/h3-6H,2,7,9H2,1H3
InChI Key:
YTWFQMHVBZSCIM-UHFFFAOYSA-N
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.999g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.508g/mol
Monoisotopic Mass:
338.999g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
147A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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