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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCSC3=C(C(=C(C(=N3)N)C#N)C4=CC=CS4)C#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCSC3=C(C(=C(C(=N3)N)C#N)C4=CC=CS4)C#N

InChI

InChI=1S/C26H19N5O2S2/c27-15-20-24(22-7-4-13-34-22)21(16-28)26(31-25(20)29)35-14-12-23(32)30-17-8-10-19(11-9-17)33-18-5-2-1-3-6-18/h1-11,13H,12,14H2,(H2,29,31)(H,30,32)