[2-methoxy-4-[(E)-[(3-methylphenyl)carbamothioylhydrazinylidene]methyl]phenyl] 4-ethoxybenzoate

Systemtic Name: [2-methoxy-4-[(E)-[(3-methylphenyl)carbamothioylhydrazinylidene]methyl]phenyl] 4-ethoxybenzoate Openeye Name: [2-methoxy-4-[(E)-(m-tolylcarbamothioylhydrazono)methyl]phenyl] 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic acid [2-methoxy-4-[(E)-[[(3-methylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(3-methylphenyl)carbamothioylhydrazinylidene]methyl]phenyl] 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [2-methoxy-4-[(E)-(m-tolylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=S)NC3=CC=CC(=C3)C)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC(=S)NC3=CC=CC(=C3)C)OC

InChI

InChI=1S/C25H25N3O4S/c1-4-31-21-11-9-19(10-12-21)24(29)32-22-13-8-18(15-23(22)30-3)16-26-28-25(33)27-20-7-5-6-17(2)14-20/h5-16H,4H2,1-3H3,(H2,27,28,33)/b26-16+