5,6-dimethoxy-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-2,3-dihydroinden-1-one

Systemtic Name: 5,6-dimethoxy-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-2,3-dihydroinden-1-one Openeye Name: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-5,6-dimethoxy-indan-1-one CAS Name: 5,6-dimethoxy-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]-2,3-dihydroinden-1-one IUPAC Name: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-5,6-dimethoxy-2,3-dihydroinden-1-one Traditional Name: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)thio]-5,6-dimethoxy-indan-1-one Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)SC3=NN=C(O3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)SC3=NN=C(O3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C20H18N2O4S/c1-24-15-9-13-10-17(19(23)14(13)11-16(15)25-2)27-20-22-21-18(26-20)8-12-6-4-3-5-7-12/h3-7,9,11,17H,8,10H2,1-2H3