[2-[(E)-3-oxidanylidene-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]prop-1-enyl]phenyl] benzoate

Systemtic Name: [2-[(E)-3-oxidanylidene-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]prop-1-enyl]phenyl] benzoate Openeye Name: [2-[(E)-3-oxo-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]prop-1-enyl]phenyl] benzoate CAS Name: benzoic acid [2-[(E)-3-oxo-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]prop-1-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-oxo-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]prop-1-enyl]phenyl] benzoate Traditional Name: benzoic acid [2-[(E)-3-keto-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]prop-1-enyl]phenyl] ester Formula: C24H17N3O3S MolecularWeight: 427.47508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C=CC3=CC=CC=C3OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)/C=C/C3=CC=CC=C3OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H17N3O3S/c28-21(25-24-27-26-22(31-24)18-10-3-1-4-11-18)16-15-17-9-7-8-14-20(17)30-23(29)19-12-5-2-6-13-19/h1-16H,(H,25,27,28)/b16-15+