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

Systemtic Name: N-(diphenylmethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Openeye Name: N-benzhydryl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide CAS Name: N-(diphenylmethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide IUPAC Name: N-benzhydryl-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Traditional Name: N-benzhydryl-1,3,4,9-tetrahydro-$b-carboline-2-carbothioamide Formula: C25H23N3S MolecularWeight: 397.53522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C3=CC=CC=C3N2)C(=S)NC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=C1C3=CC=CC=C3N2)C(=S)NC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H23N3S/c29-25(27-24(18-9-3-1-4-10-18)19-11-5-2-6-12-19)28-16-15-21-20-13-7-8-14-22(20)26-23(21)17-28/h1-14,24,26H,15-17H2,(H,27,29)