N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-4-propan-2-ylsulfanyl-benzamide

Systemtic Name: N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-4-propan-2-ylsulfanyl-benzamide Openeye Name: 4-isopropylsulfanyl-N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide CAS Name: N-[5-[[4-(methylthio)phenyl]methyl]-1,3,4-oxadiazol-2-yl]-4-(propan-2-ylthio)benzamide IUPAC Name: N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-4-propan-2-ylsulfanylbenzamide Traditional Name: 4-(isopropylthio)-N-[5-[4-(methylthio)benzyl]-1,3,4-oxadiazol-2-yl]benzamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)C(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)C(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H21N3O2S2/c1-13(2)27-17-10-6-15(7-11-17)19(24)21-20-23-22-18(25-20)12-14-4-8-16(26-3)9-5-14/h4-11,13H,12H2,1-3H3,(H,21,23,24)