1-[1-[2-(2-methylphenoxy)ethyl]indol-3-yl]carbothioylpiperidine-4-carboxamide

Systemtic Name: 1-[1-[2-(2-methylphenoxy)ethyl]indol-3-yl]carbothioylpiperidine-4-carboxamide Openeye Name: 1-[1-[2-(2-methylphenoxy)ethyl]indole-3-carbothioyl]piperidine-4-carboxamide CAS Name: 1-[[1-[2-(2-methylphenoxy)ethyl]-3-indolyl]-sulfanylidenemethyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-[2-(2-methylphenoxy)ethyl]indole-3-carbothioyl]piperidine-4-carboxamide Traditional Name: 1-[1-[2-(2-methylphenoxy)ethyl]indole-3-carbothioyl]isonipecotamide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCN2C=C(C3=CC=CC=C32)C(=S)N4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1OCCN2C=C(C3=CC=CC=C32)C(=S)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C24H27N3O2S/c1-17-6-2-5-9-22(17)29-15-14-27-16-20(19-7-3-4-8-21(19)27)24(30)26-12-10-18(11-13-26)23(25)28/h2-9,16,18H,10-15H2,1H3,(H2,25,28)