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

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-thiophen-3-yl-pyridin-2-yl)sulfanyl-N-(4-phenoxyphenyl)propanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(3-thienyl)-2-pyridyl]sulfanyl]-N-(4-phenoxyphenyl)propanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(3-thiophenyl)-2-pyridinyl]thio]-N-(4-phenoxyphenyl)propanamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-thiophen-3-ylpyridin-2-yl)sulfanyl-N-(4-phenoxyphenyl)propanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(3-thienyl)-2-pyridyl]thio]-N-(4-phenoxyphenyl)propionamide Formula: C26H19N5O2S2 MolecularWeight: 497.59136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=C(C(=C(C(=N3)N)C#N)C4=CSC=C4)C#N

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=C(C(=C(C(=N3)N)C#N)C4=CSC=C4)C#N

InChI

InChI=1S/C26H19N5O2S2/c1-16(25(32)30-18-7-9-20(10-8-18)33-19-5-3-2-4-6-19)35-26-22(14-28)23(17-11-12-34-15-17)21(13-27)24(29)31-26/h2-12,15-16H,1H3,(H2,29,31)(H,30,32)