phenyl 5-[methyl-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylcarbonyl]amino]-1-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: phenyl 5-[methyl-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylcarbonyl]amino]-1-oxidanyl-naphthalene-2-carboxylate Openeye Name: phenyl 1-hydroxy-5-[methyl-(1-phenyltetrazol-5-yl)sulfanylcarbonyl-amino]naphthalene-2-carboxylate CAS Name: 1-hydroxy-5-[methyl-[oxo-[(1-phenyl-5-tetrazolyl)thio]methyl]amino]-2-naphthalenecarboxylic acid phenyl ester IUPAC Name: phenyl 1-hydroxy-5-[methyl-(1-phenyltetrazol-5-yl)sulfanylcarbonylamino]naphthalene-2-carboxylate Traditional Name: 1-hydroxy-5-[methyl-[(1-phenyltetrazol-5-yl)thio]carbonyl-amino]naphthalene-2-carboxylic acid phenyl ester Formula: C26H19N5O4S MolecularWeight: 497.52516

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC2=C1C=CC(=C2O)C(=O)OC3=CC=CC=C3)C(=O)SC4=NN=NN4C5=CC=CC=C5

Isomeric SMILES

CN(C1=CC=CC2=C1C=CC(=C2O)C(=O)OC3=CC=CC=C3)C(=O)SC4=NN=NN4C5=CC=CC=C5

InChI

InChI=1S/C26H19N5O4S/c1-30(26(34)36-25-27-28-29-31(25)17-9-4-2-5-10-17)22-14-8-13-20-19(22)15-16-21(23(20)32)24(33)35-18-11-6-3-7-12-18/h2-16,32H,1H3