1-ethyl-N-(3-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide

Systemtic Name: 1-ethyl-N-(3-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Openeye Name: 1-ethyl-N-(3-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide CAS Name: 1-ethyl-N-(3-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide IUPAC Name: 1-ethyl-N-(3-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Traditional Name: 1-ethyl-N-(3-methoxyphenyl)-1,3,4,9-tetrahydro-$b-carboline-2-carbothioamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1C(=S)NC3=CC(=CC=C3)OC)C4=CC=CC=C4N2

Isomeric SMILES

CCC1C2=C(CCN1C(=S)NC3=CC(=CC=C3)OC)C4=CC=CC=C4N2

InChI

InChI=1S/C21H23N3OS/c1-3-19-20-17(16-9-4-5-10-18(16)23-20)11-12-24(19)21(26)22-14-7-6-8-15(13-14)25-2/h4-10,13,19,23H,3,11-12H2,1-2H3,(H,22,26)