3-(6-azanyl-3,5-dicyano-4-thiophen-3-yl-pyridin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)propanamide

Systemtic Name: 3-(6-azanyl-3,5-dicyano-4-thiophen-3-yl-pyridin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)propanamide Openeye Name: 3-[[6-amino-3,5-dicyano-4-(3-thienyl)-2-pyridyl]sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide CAS Name: 3-[[6-amino-3,5-dicyano-4-(3-thiophenyl)-2-pyridinyl]thio]-N-(3,5-dimethoxyphenyl)propanamide IUPAC Name: 3-(6-amino-3,5-dicyano-4-thiophen-3-ylpyridin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)propanamide Traditional Name: 3-[[6-amino-3,5-dicyano-4-(3-thienyl)-2-pyridyl]thio]-N-(3,5-dimethoxyphenyl)propionamide Formula: C22H19N5O3S2 MolecularWeight: 465.54796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CCSC2=C(C(=C(C(=N2)N)C#N)C3=CSC=C3)C#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CCSC2=C(C(=C(C(=N2)N)C#N)C3=CSC=C3)C#N)OC

InChI

InChI=1S/C22H19N5O3S2/c1-29-15-7-14(8-16(9-15)30-2)26-19(28)4-6-32-22-18(11-24)20(13-3-5-31-12-13)17(10-23)21(25)27-22/h3,5,7-9,12H,4,6H2,1-2H3,(H2,25,27)(H,26,28)