3-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-benzyl-3-[(7-methylindan-4-yl)oxymethyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-benzyl-3-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-benzyl-3-[(7-methylindan-4-yl)oxymethyl]-1H-1,2,4-triazole-5-thione Formula: C20H21N3OS MolecularWeight: 351.46524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCC2=C(C=C1)OCC3=NNC(=S)N3CC4=CC=CC=C4

Isomeric SMILES

CC1=C2CCCC2=C(C=C1)OCC3=NNC(=S)N3CC4=CC=CC=C4

InChI

InChI=1S/C20H21N3OS/c1-14-10-11-18(17-9-5-8-16(14)17)24-13-19-21-22-20(25)23(19)12-15-6-3-2-4-7-15/h2-4,6-7,10-11H,5,8-9,12-13H2,1H3,(H,22,25)