4-[[5-cyano-4-oxidanylidene-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylquinolin-6-yl)benzenesulfonamide

Systemtic Name: 4-[[5-cyano-4-oxidanylidene-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylquinolin-6-yl)benzenesulfonamide Openeye Name: 4-[[5-cyano-4-oxo-6-[5-(2-thienyl)-2-thienyl]-1H-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methyl-6-quinolyl)benzenesulfonamide CAS Name: 4-[[[5-cyano-4-oxo-6-(5-thiophen-2-yl-2-thiophenyl)-1H-pyrimidin-2-yl]thio]methyl]-N-(2-methyl-6-quinolinyl)benzenesulfonamide IUPAC Name: 4-[[5-cyano-4-oxo-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylquinolin-6-yl)benzenesulfonamide Traditional Name: 4-[[[5-cyano-4-keto-6-[5-(2-thienyl)-2-thienyl]-1H-pyrimidin-2-yl]thio]methyl]-N-(2-methyl-6-quinolyl)benzenesulfonamide Formula: C30H21N5O3S4 MolecularWeight: 627.77944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)CSC4=NC(=O)C(=C(N4)C5=CC=C(S5)C6=CC=CS6)C#N

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)CSC4=NC(=O)C(=C(N4)C5=CC=C(S5)C6=CC=CS6)C#N

InChI

InChI=1S/C30H21N5O3S4/c1-18-4-7-20-15-21(8-11-24(20)32-18)35-42(37,38)22-9-5-19(6-10-22)17-40-30-33-28(23(16-31)29(36)34-30)27-13-12-26(41-27)25-3-2-14-39-25/h2-15,35H,17H2,1H3,(H,33,34,36)