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

Systemtic Name: N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-3-propan-2-ylsulfonyl-benzamide Openeye Name: N-[5-(3-isopropylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-3-isopropylsulfonyl-benzamide CAS Name: 3-propan-2-ylsulfonyl-N-[5-[3-(propan-2-ylthio)phenyl]-1,3,4-oxadiazol-2-yl]benzamide IUPAC Name: N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-3-propan-2-ylsulfonylbenzamide Traditional Name: 3-isopropylsulfonyl-N-[5-[3-(isopropylthio)phenyl]-1,3,4-oxadiazol-2-yl]benzamide 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)C3=CC(=CC=C3)S(=O)(=O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S2/c1-13(2)29-17-9-5-8-16(11-17)20-23-24-21(28-20)22-19(25)15-7-6-10-18(12-15)30(26,27)14(3)4/h5-14H,1-4H3,(H,22,24,25)