[4-[(E)-[(2-methylphenyl)carbamothioylhydrazinylidene]methyl]phenyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [4-[(E)-[(2-methylphenyl)carbamothioylhydrazinylidene]methyl]phenyl] (E)-3-phenylprop-2-enoate Openeye Name: [4-[(E)-(o-tolylcarbamothioylhydrazono)methyl]phenyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [4-[(E)-[[(2-methylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(2-methylphenyl)carbamothioylhydrazinylidene]methyl]phenyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [4-[(E)-(o-tolylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NN=CC2=CC=C(C=C2)OC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N/N=C/C2=CC=C(C=C2)OC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H21N3O2S/c1-18-7-5-6-10-22(18)26-24(30)27-25-17-20-11-14-21(15-12-20)29-23(28)16-13-19-8-3-2-4-9-19/h2-17H,1H3,(H2,26,27,30)/b16-13+,25-17+