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

Systemtic Name: methyl 4-[(E)-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)amino]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)amino]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)amino]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)amino]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)NC2=NN=C(S2)C3CC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=NN=C(S2)C3CC3

InChI

InChI=1S/C16H15N3O3S/c1-22-15(21)12-5-2-10(3-6-12)4-9-13(20)17-16-19-18-14(23-16)11-7-8-11/h2-6,9,11H,7-8H2,1H3,(H,17,19,20)/b9-4+