2,8-dimethyl-N-(3-methylphenyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-5-carbothioamide

Systemtic Name: 2,8-dimethyl-N-(3-methylphenyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-5-carbothioamide Openeye Name: 2,8-dimethyl-N-(m-tolyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-5-carbothioamide CAS Name: 2,8-dimethyl-N-(3-methylphenyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-5-carbothioamide IUPAC Name: 2,8-dimethyl-N-(3-methylphenyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-5-carbothioamide Traditional Name: 2,8-dimethyl-N-(m-tolyl)-3,4,4a,9b-tetrahydro-1H-pyrid[4,3-b]indole-5-carbothioamide Formula: C21H25N3S MolecularWeight: 351.5083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N2C3CCN(CC3C4=C2C=CC(=C4)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N2C3CCN(CC3C4=C2C=CC(=C4)C)C

InChI

InChI=1S/C21H25N3S/c1-14-5-4-6-16(11-14)22-21(25)24-19-8-7-15(2)12-17(19)18-13-23(3)10-9-20(18)24/h4-8,11-12,18,20H,9-10,13H2,1-3H3,(H,22,25)