[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxy-phenyl] 4-chloranylbenzoate

Systemtic Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxy-phenyl] 4-chloranylbenzoate Openeye Name: [4-[(E)-(carbamothioylhydrazono)methyl]-2-ethoxy-phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxyphenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-ethoxy-4-[(E)-(thiocarbamoylhydrazono)methyl]phenyl] ester Formula: C17H16ClN3O3S MolecularWeight: 377.84524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=S)N)OC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=S)N)OC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H16ClN3O3S/c1-2-23-15-9-11(10-20-21-17(19)25)3-8-14(15)24-16(22)12-4-6-13(18)7-5-12/h3-10H,2H2,1H3,(H3,19,21,25)/b20-10+