2-[6-azanyl-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)butanamide

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)butanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]sulfanyl]-N-(2-methyl-4-quinolyl)butanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]thio]-N-(2-methyl-4-quinolinyl)butanamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)butanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]thio]-N-(2-methyl-4-quinolyl)butyramide Formula: C30H28N6O4S MolecularWeight: 568.64612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=NC2=CC=CC=C21)C)SC3=C(C(=C(C(=N3)N)C#N)C4=CC(=C(C(=C4)OC)OC)OC)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC(=NC2=CC=CC=C21)C)SC3=C(C(=C(C(=N3)N)C#N)C4=CC(=C(C(=C4)OC)OC)OC)C#N

InChI

InChI=1S/C30H28N6O4S/c1-6-25(29(37)35-22-11-16(2)34-21-10-8-7-9-18(21)22)41-30-20(15-32)26(19(14-31)28(33)36-30)17-12-23(38-3)27(40-5)24(13-17)39-4/h7-13,25H,6H2,1-5H3,(H2,33,36)(H,34,35,37)