4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl naphthalene-1-carboxylate

Systemtic Name: 4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl naphthalene-1-carboxylate Openeye Name: 4-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid 4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester IUPAC Name: 4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid 4-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester Formula: C24H18N2O3S MolecularWeight: 414.47632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(O2)SCC#CCOC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(O2)SCC#CCOC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H18N2O3S/c1-17-11-13-19(14-12-17)22-25-26-24(29-22)30-16-5-4-15-28-23(27)21-10-6-8-18-7-2-3-9-20(18)21/h2-3,6-14H,15-16H2,1H3