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

Systemtic Name: 2,8-dimethyl-N-(phenylmethyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-5-carbothioamide Openeye Name: N-benzyl-2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-5-carbothioamide CAS Name: 2,8-dimethyl-N-(phenylmethyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-5-carbothioamide IUPAC Name: N-benzyl-2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-5-carbothioamide Traditional Name: N-benzyl-2,8-dimethyl-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=CC2=C(C=C1)N(C3C2CN(CC3)C)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3C2CN(CC3)C)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C21H25N3S/c1-15-8-9-19-17(12-15)18-14-23(2)11-10-20(18)24(19)21(25)22-13-16-6-4-3-5-7-16/h3-9,12,18,20H,10-11,13-14H2,1-2H3,(H,22,25)