[1-[(E)-[(4-methoxyphenyl)carbamothioylhydrazinylidene]methyl]naphthalen-2-yl] 3-methylbenzoate

Systemtic Name: [1-[(E)-[(4-methoxyphenyl)carbamothioylhydrazinylidene]methyl]naphthalen-2-yl] 3-methylbenzoate Openeye Name: [1-[(E)-[(4-methoxyphenyl)carbamothioylhydrazono]methyl]-2-naphthyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [1-[(E)-[[(4-methoxyanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]-2-naphthalenyl] ester IUPAC Name: [1-[(E)-[(4-methoxyphenyl)carbamothioylhydrazinylidene]methyl]naphthalen-2-yl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [1-[(E)-[(4-methoxyphenyl)thiocarbamoylhydrazono]methyl]-2-naphthyl] ester Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)C=NNC(=S)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)/C=N/NC(=S)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C27H23N3O3S/c1-18-6-5-8-20(16-18)26(31)33-25-15-10-19-7-3-4-9-23(19)24(25)17-28-30-27(34)29-21-11-13-22(32-2)14-12-21/h3-17H,1-2H3,(H2,29,30,34)/b28-17+