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

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-(4-phenoxyphenyl)propanamide Openeye Name: 2-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)sulfanyl]-N-(4-phenoxyphenyl)propanamide CAS Name: 2-[(6-amino-3,5-dicyano-4-phenyl-2-pyridinyl)thio]-N-(4-phenoxyphenyl)propanamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-phenylpyridin-2-yl)sulfanyl-N-(4-phenoxyphenyl)propanamide Traditional Name: 2-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)thio]-N-(4-phenoxyphenyl)propionamide Formula: C28H21N5O2S MolecularWeight: 491.56364

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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=CC=CC=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=CC=CC=C4)C#N

InChI

InChI=1S/C28H21N5O2S/c1-18(27(34)32-20-12-14-22(15-13-20)35-21-10-6-3-7-11-21)36-28-24(17-30)25(19-8-4-2-5-9-19)23(16-29)26(31)33-28/h2-15,18H,1H3,(H2,31,33)(H,32,34)