2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-(9-ethylcarbazol-3-yl)propanamide

Systemtic Name: 2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-(9-ethylcarbazol-3-yl)propanamide Openeye Name: 2-[(3-cyano-6-isobutyl-2-pyridyl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide CAS Name: 2-[[3-cyano-6-(2-methylpropyl)-2-pyridinyl]thio]-N-(9-ethyl-3-carbazolyl)propanamide IUPAC Name: 2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-(9-ethylcarbazol-3-yl)propanamide Traditional Name: 2-[(3-cyano-6-isobutyl-2-pyridyl)thio]-N-(9-ethylcarbazol-3-yl)propionamide Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C)SC3=C(C=CC(=N3)CC(C)C)C#N)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C(C)SC3=C(C=CC(=N3)CC(C)C)C#N)C4=CC=CC=C41

InChI

InChI=1S/C27H28N4OS/c1-5-31-24-9-7-6-8-22(24)23-15-21(12-13-25(23)31)29-26(32)18(4)33-27-19(16-28)10-11-20(30-27)14-17(2)3/h6-13,15,17-18H,5,14H2,1-4H3,(H,29,32)