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

Systemtic Name: 3-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl]sulfanyl-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazol-5-one Openeye Name: 3-(2-indan-5-yl-2-oxo-ethyl)sulfanyl-4-(tetrahydrofuran-2-ylmethyl)-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]thio]-4-(2-oxolanylmethyl)-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]sulfanyl-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazol-5-one Traditional Name: 3-[(2-indan-5-yl-2-keto-ethyl)thio]-4-(tetrahydrofurfuryl)-1H-1,2,4-triazol-5-one Formula: C18H21N3O3S MolecularWeight: 359.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)NN=C2SCC(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

C1CC(OC1)CN2C(=O)NN=C2SCC(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C18H21N3O3S/c22-16(14-7-6-12-3-1-4-13(12)9-14)11-25-18-20-19-17(23)21(18)10-15-5-2-8-24-15/h6-7,9,15H,1-5,8,10-11H2,(H,19,23)