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

Systemtic Name: N-(diphenylmethyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Openeye Name: N-benzhydryl-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide CAS Name: N-(diphenylmethyl)-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide IUPAC Name: N-benzhydryl-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Traditional Name: N-benzhydryl-1-ethyl-1,3,4,9-tetrahydro-$b-carboline-2-carbothioamide Formula: C27H27N3S MolecularWeight: 425.58838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1C(=S)NC(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5N2

Isomeric SMILES

CCC1C2=C(CCN1C(=S)NC(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5N2

InChI

InChI=1S/C27H27N3S/c1-2-24-26-22(21-15-9-10-16-23(21)28-26)17-18-30(24)27(31)29-25(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-16,24-25,28H,2,17-18H2,1H3,(H,29,31)