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

Systemtic Name: N-(4-dimethylaminophenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Openeye Name: N-(4-dimethylaminophenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide CAS Name: N-(4-dimethylaminophenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide IUPAC Name: N-(4-dimethylaminophenyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Traditional Name: N-(4-dimethylaminophenyl)-1-ethyl-1,3,4,9-tetrahydro-$b-carboline-2-carbothioamide Formula: C22H26N4S MolecularWeight: 378.53364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4S/c1-4-20-21-18(17-7-5-6-8-19(17)24-21)13-14-26(20)22(27)23-15-9-11-16(12-10-15)25(2)3/h5-12,20,24H,4,13-14H2,1-3H3,(H,23,27)