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

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

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


Isomeric SMILES

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


InChI

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


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