5,6-dimethoxy-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-2,3-dihydroinden-1-one

Systemtic Name: 5,6-dimethoxy-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-2,3-dihydroinden-1-one Openeye Name: 2-[[4-allyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-5,6-dimethoxy-indan-1-one CAS Name: 5,6-dimethoxy-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-2,3-dihydroinden-1-one IUPAC Name: 5,6-dimethoxy-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-2,3-dihydroinden-1-one Traditional Name: 2-[[4-allyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-5,6-dimethoxy-indan-1-one Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2CC=C)SC3CC4=CC(=C(C=C4C3=O)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2CC=C)SC3CC4=CC(=C(C=C4C3=O)OC)OC

InChI

InChI=1S/C23H23N3O4S/c1-5-10-26-22(14-6-8-16(28-2)9-7-14)24-25-23(26)31-20-12-15-11-18(29-3)19(30-4)13-17(15)21(20)27/h5-9,11,13,20H,1,10,12H2,2-4H3