4-(phenylsulfonyl)-N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]butanamide

Systemtic Name: 4-(phenylsulfonyl)-N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]butanamide Openeye Name: 4-(benzenesulfonyl)-N-[5-(3-isopropylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]butanamide CAS Name: 4-(benzenesulfonyl)-N-[5-[3-(propan-2-ylthio)phenyl]-1,3,4-oxadiazol-2-yl]butanamide IUPAC Name: 4-(benzenesulfonyl)-N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]butanamide Traditional Name: 4-besyl-N-[5-[3-(isopropylthio)phenyl]-1,3,4-oxadiazol-2-yl]butyramide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC(=C1)C2=NN=C(O2)NC(=O)CCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)SC1=CC=CC(=C1)C2=NN=C(O2)NC(=O)CCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O4S2/c1-15(2)29-17-9-6-8-16(14-17)20-23-24-21(28-20)22-19(25)12-7-13-30(26,27)18-10-4-3-5-11-18/h3-6,8-11,14-15H,7,12-13H2,1-2H3,(H,22,24,25)