2-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(2-thienyl)-2-pyridyl]sulfanyl]-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide CAS Name: 2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)thio]-N-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]butanamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-thiophen-2-ylpyridin-2-yl)sulfanyl-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(2-thienyl)-2-pyridyl]thio]-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]butyramide Formula: C27H24N8O3S3 MolecularWeight: 604.72626

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)C)C)SC3=C(C(=C(C(=N3)N)C#N)C4=CC=CS4)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)C)C)SC3=C(C(=C(C(=N3)N)C#N)C4=CC=CS4)C#N

InChI

InChI=1S/C27H24N8O3S3/c1-4-21(40-26-20(14-29)23(22-6-5-11-39-22)19(13-28)24(30)34-26)25(36)33-17-7-9-18(10-8-17)41(37,38)35-27-31-15(2)12-16(3)32-27/h5-12,21H,4H2,1-3H3,(H2,30,34)(H,33,36)(H,31,32,35)