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

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(4-ethylphenyl)pyridin-2-yl]sulfanyl-N-(9-ethylcarbazol-3-yl)butanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(4-ethylphenyl)-2-pyridyl]sulfanyl]-N-(9-ethylcarbazol-3-yl)butanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(4-ethylphenyl)-2-pyridinyl]thio]-N-(9-ethyl-3-carbazolyl)butanamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(4-ethylphenyl)pyridin-2-yl]sulfanyl-N-(9-ethylcarbazol-3-yl)butanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(4-ethylphenyl)-2-pyridyl]thio]-N-(9-ethylcarbazol-3-yl)butyramide Formula: C33H30N6OS MolecularWeight: 558.6959

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SC(CC)C(=O)NC3=CC4=C(C=C3)N(C5=CC=CC=C54)CC)N)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SC(CC)C(=O)NC3=CC4=C(C=C3)N(C5=CC=CC=C54)CC)N)C#N

InChI

InChI=1S/C33H30N6OS/c1-4-20-11-13-21(14-12-20)30-25(18-34)31(36)38-33(26(30)19-35)41-29(5-2)32(40)37-22-15-16-28-24(17-22)23-9-7-8-10-27(23)39(28)6-3/h7-17,29H,4-6H2,1-3H3,(H2,36,38)(H,37,40)