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

Systemtic Name: 3-(6-azanyl-3,5-dicyano-4-propan-2-yl-pyridin-2-yl)sulfanyl-N-(9-ethylcarbazol-3-yl)propanamide Openeye Name: 3-[(6-amino-3,5-dicyano-4-isopropyl-2-pyridyl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide CAS Name: 3-[(6-amino-3,5-dicyano-4-propan-2-yl-2-pyridinyl)thio]-N-(9-ethyl-3-carbazolyl)propanamide IUPAC Name: 3-(6-amino-3,5-dicyano-4-propan-2-ylpyridin-2-yl)sulfanyl-N-(9-ethylcarbazol-3-yl)propanamide Traditional Name: 3-[(6-amino-3,5-dicyano-4-isopropyl-2-pyridyl)thio]-N-(9-ethylcarbazol-3-yl)propionamide Formula: C27H26N6OS MolecularWeight: 482.59994

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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)C(C)C)C#N)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)CCSC3=C(C(=C(C(=N3)N)C#N)C(C)C)C#N)C4=CC=CC=C41

InChI

InChI=1S/C27H26N6OS/c1-4-33-22-8-6-5-7-18(22)19-13-17(9-10-23(19)33)31-24(34)11-12-35-27-21(15-29)25(16(2)3)20(14-28)26(30)32-27/h5-10,13,16H,4,11-12H2,1-3H3,(H2,30,32)(H,31,34)