4-(2,3-dihydro-1H-inden-2-yl)-3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(2,3-dihydro-1H-inden-2-yl)-3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-indan-2-yl-3-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-1H-1,2,4-triazol-5-one CAS Name: 4-(2,3-dihydro-1H-inden-2-yl)-3-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-(2,3-dihydro-1H-inden-2-yl)-3-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 4-indan-2-yl-3-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-1H-1,2,4-triazol-5-one Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NNC(=O)N2C3CC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NNC(=O)N2C3CC4=CC=CC=C4C3

InChI

InChI=1S/C20H19N3O3S/c1-26-17-8-6-13(7-9-17)18(24)12-27-20-22-21-19(25)23(20)16-10-14-4-2-3-5-15(14)11-16/h2-9,16H,10-12H2,1H3,(H,21,25)