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

Systemtic Name: 5-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(7-methylindan-4-yl)oxymethyl]-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxymethyl]-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(7-methylindan-4-yl)oxymethyl]-4-phenyl-1,2,4-triazole-3-thiolate Formula: C19H18N3OS- MolecularWeight: 336.43072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCC2=C(C=C1)OCC3=NN=C(N3C4=CC=CC=C4)[S-]

Isomeric SMILES

CC1=C2CCCC2=C(C=C1)OCC3=NN=C(N3C4=CC=CC=C4)[S-]

InChI

InChI=1S/C19H19N3OS/c1-13-10-11-17(16-9-5-8-15(13)16)23-12-18-20-21-19(24)22(18)14-6-3-2-4-7-14/h2-4,6-7,10-11H,5,8-9,12H2,1H3,(H,21,24)/p-1