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

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide CAS Name: N-(2-chloro-4-methylphenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide IUPAC Name: N-(2-chloro-4-methylphenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Traditional Name: N-(2-chloro-4-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=C(C=C3)C)Cl)C4=CC=CC=C4N2

Isomeric SMILES

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

InChI

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