N-(3-butylsulfanylpropyl)-1-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide

Systemtic Name: N-(3-butylsulfanylpropyl)-1-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide Openeye Name: N-(3-butylsulfanylpropyl)-1-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methyl]piperidine-4-carboxamide CAS Name: N-[3-(butylthio)propyl]-1-[[5-methyl-2-(2-methylphenyl)-4-oxazolyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-(3-butylsulfanylpropyl)-1-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide Traditional Name: N-[3-(butylthio)propyl]-1-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methyl]isonipecotamide Formula: C25H37N3O2S MolecularWeight: 443.64518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCNC(=O)C1CCN(CC1)CC2=C(OC(=N2)C3=CC=CC=C3C)C

Isomeric SMILES

CCCCSCCCNC(=O)C1CCN(CC1)CC2=C(OC(=N2)C3=CC=CC=C3C)C

InChI

InChI=1S/C25H37N3O2S/c1-4-5-16-31-17-8-13-26-24(29)21-11-14-28(15-12-21)18-23-20(3)30-25(27-23)22-10-7-6-9-19(22)2/h6-7,9-10,21H,4-5,8,11-18H2,1-3H3,(H,26,29)