(7-methoxynaphthalen-2-yl) 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: (7-methoxynaphthalen-2-yl) 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: (7-methoxy-2-naphthyl) 2-[[4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]acetic acid (7-methoxy-2-naphthalenyl) ester IUPAC Name: (7-methoxynaphthalen-2-yl) 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetic acid (7-methoxy-2-naphthyl) ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)OC3=CC4=C(C=CC(=C4)OC)C=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)OC3=CC4=C(C=CC(=C4)OC)C=C3

InChI

InChI=1S/C22H19N3O3S/c1-15-3-7-18(8-4-15)25-14-23-24-22(25)29-13-21(26)28-20-10-6-16-5-9-19(27-2)11-17(16)12-20/h3-12,14H,13H2,1-2H3