N-(3-butylsulfanylpropyl)-1-(5-indol-1-ylthiophen-2-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-butylsulfanylpropyl)-1-(5-indol-1-ylthiophen-2-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-butylsulfanylpropyl)-1-(5-indol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[3-(butylthio)propyl]-1-[[5-(1-indolyl)-2-thiophenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-butylsulfanylpropyl)-1-(5-indol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[3-(butylthio)propyl]-1-(5-indol-1-ylthiophene-2-carbonyl)isonipecotamide Formula: C26H33N3O2S2 MolecularWeight: 483.68912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCNC(=O)C1CCN(CC1)C(=O)C2=CC=C(S2)N3C=CC4=CC=CC=C43

Isomeric SMILES

CCCCSCCCNC(=O)C1CCN(CC1)C(=O)C2=CC=C(S2)N3C=CC4=CC=CC=C43

InChI

InChI=1S/C26H33N3O2S2/c1-2-3-18-32-19-6-14-27-25(30)21-11-15-28(16-12-21)26(31)23-9-10-24(33-23)29-17-13-20-7-4-5-8-22(20)29/h4-5,7-10,13,17,21H,2-3,6,11-12,14-16,18-19H2,1H3,(H,27,30)