[2-ethoxy-4-[(E)-[[2-oxidanylidene-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]ethanoyl]hydrazinylidene]methyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [2-ethoxy-4-[(E)-[[2-oxidanylidene-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]ethanoyl]hydrazinylidene]methyl]phenyl] 4-chloranylbenzoate Openeye Name: [2-ethoxy-4-[(E)-[[2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetyl]hydrazono]methyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[(E)-[[1,2-dioxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]ethyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [2-ethoxy-4-[(E)-[[2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-ethoxy-4-[(E)-[[2-keto-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetyl]hydrazono]methyl]phenyl] ester Formula: C26H20ClN5O5S MolecularWeight: 549.9855

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)C(=O)NC2=NN=C(S2)C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=O)C(=O)NC2=NN=C(S2)C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H20ClN5O5S/c1-2-36-21-14-16(8-13-20(21)37-25(35)18-9-11-19(27)12-10-18)15-28-30-23(34)22(33)29-26-32-31-24(38-26)17-6-4-3-5-7-17/h3-15H,2H2,1H3,(H,30,34)(H,29,32,33)/b28-15+