N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-4-carboxamide Openeye Name: N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-4-carboxamide CAS Name: N-[2-methyl-4-[(phenylthio)methyl]phenyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-4-carboxamide Traditional Name: N-[2-methyl-4-[(phenylthio)methyl]phenyl]-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]isonipecotamide Formula: C27H28N4O2S2 MolecularWeight: 504.66682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)C3CCN(CC3)CC4=NC(=NO4)C5=CC=CS5

Isomeric SMILES

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)C3CCN(CC3)CC4=NC(=NO4)C5=CC=CS5

InChI

InChI=1S/C27H28N4O2S2/c1-19-16-20(18-35-22-6-3-2-4-7-22)9-10-23(19)28-27(32)21-11-13-31(14-12-21)17-25-29-26(30-33-25)24-8-5-15-34-24/h2-10,15-16,21H,11-14,17-18H2,1H3,(H,28,32)