2-[2-(1H-indol-3-yl)ethylamino]-4,4-dimethyl-6-oxidanylidene-N-phenyl-cyclohexene-1-carbothioamide

Systemtic Name: 2-[2-(1H-indol-3-yl)ethylamino]-4,4-dimethyl-6-oxidanylidene-N-phenyl-cyclohexene-1-carbothioamide Openeye Name: 2-[2-(1H-indol-3-yl)ethylamino]-4,4-dimethyl-6-oxo-N-phenyl-cyclohexene-1-carbothioamide CAS Name: 2-[2-(1H-indol-3-yl)ethylamino]-4,4-dimethyl-6-oxo-N-phenyl-1-cyclohexenecarbothioamide IUPAC Name: 2-[2-(1H-indol-3-yl)ethylamino]-4,4-dimethyl-6-oxo-N-phenylcyclohexene-1-carbothioamide Traditional Name: 2-[2-(1H-indol-3-yl)ethylamino]-6-keto-4,4-dimethyl-N-phenyl-cyclohexene-1-carbothioamide Formula: C25H27N3OS MolecularWeight: 417.56638

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=CC=C2)NCCC3=CNC4=CC=CC=C43)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=CC=C2)NCCC3=CNC4=CC=CC=C43)C

InChI

InChI=1S/C25H27N3OS/c1-25(2)14-21(26-13-12-17-16-27-20-11-7-6-10-19(17)20)23(22(29)15-25)24(30)28-18-8-4-3-5-9-18/h3-11,16,26-27H,12-15H2,1-2H3,(H,28,30)