N-(2-methoxy-5-methyl-phenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide CAS Name: N-(2-methoxy-5-methylphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-1,3,4,9-tetrahydro-$b-carboline-2-carbothioamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)N2CCC3=C(C2)NC4=CC=CC=C34

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)N2CCC3=C(C2)NC4=CC=CC=C34

InChI

InChI=1S/C20H21N3OS/c1-13-7-8-19(24-2)17(11-13)22-20(25)23-10-9-15-14-5-3-4-6-16(14)21-18(15)12-23/h3-8,11,21H,9-10,12H2,1-2H3,(H,22,25)