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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide CAS Name: N-(3-chloro-2-methylphenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide IUPAC Name: N-(3-chloro-2-methylphenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-1-ethyl-1,3,4,9-tetrahydro-$b-carboline-2-carbothioamide Formula: C21H22ClN3S MolecularWeight: 383.93748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3S/c1-3-19-20-15(14-7-4-5-9-18(14)23-20)11-12-25(19)21(26)24-17-10-6-8-16(22)13(17)2/h4-10,19,23H,3,11-12H2,1-2H3,(H,24,26)