[4-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxy-phenyl] 4-ethoxybenzoate

Systemtic Name: [4-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxy-phenyl] 4-ethoxybenzoate Openeye Name: [4-[(E)-(ethylcarbamothioylhydrazono)methyl]-2-methoxy-phenyl] 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic acid [4-[(E)-[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [4-[(E)-(ethylthiocarbamoylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)OCC)OC

Isomeric SMILES

CCNC(=S)N/N=C/C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)OCC)OC

InChI

InChI=1S/C20H23N3O4S/c1-4-21-20(28)23-22-13-14-6-11-17(18(12-14)25-3)27-19(24)15-7-9-16(10-8-15)26-5-2/h6-13H,4-5H2,1-3H3,(H2,21,23,28)/b22-13+