3-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(9-ethylcarbazol-3-yl)propanamide

Systemtic Name: 3-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(9-ethylcarbazol-3-yl)propanamide Openeye Name: 3-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide CAS Name: 3-[[6-amino-3,5-dicyano-4-(4-methylphenyl)-2-pyridinyl]thio]-N-(9-ethyl-3-carbazolyl)propanamide IUPAC Name: 3-[6-amino-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(9-ethylcarbazol-3-yl)propanamide Traditional Name: 3-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]thio]-N-(9-ethylcarbazol-3-yl)propionamide Formula: C31H26N6OS MolecularWeight: 530.64274

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)CCSC3=C(C(=C(C(=N3)N)C#N)C4=CC=C(C=C4)C)C#N)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)CCSC3=C(C(=C(C(=N3)N)C#N)C4=CC=C(C=C4)C)C#N)C5=CC=CC=C51

InChI

InChI=1S/C31H26N6OS/c1-3-37-26-7-5-4-6-22(26)23-16-21(12-13-27(23)37)35-28(38)14-15-39-31-25(18-33)29(24(17-32)30(34)36-31)20-10-8-19(2)9-11-20/h4-13,16H,3,14-15H2,1-2H3,(H2,34,36)(H,35,38)