N-[5-(4-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[5-(4-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[5-(4-isopropylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[5-[4-(propan-2-ylthio)phenyl]-1,3,4-oxadiazol-2-yl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[5-(4-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[5-[4-(isopropylthio)phenyl]-1,3,4-oxadiazol-2-yl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H24N4O4S3 MolecularWeight: 492.63466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)C2=NN=C(O2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)C2=NN=C(O2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H24N4O4S3/c1-14(2)31-17-7-5-16(6-8-17)20-23-24-21(29-20)22-19(26)15-9-11-25(12-10-15)32(27,28)18-4-3-13-30-18/h3-8,13-15H,9-12H2,1-2H3,(H,22,24,26)