(3-chloranyl-1-oxidanylidene-1-phenyl-propan-2-yl) 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (3-chloranyl-1-oxidanylidene-1-phenyl-propan-2-yl) 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: [1-(chloromethyl)-2-oxo-2-phenyl-ethyl] 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxo-butanoate CAS Name: 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxobutanoic acid (3-chloro-1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (3-chloro-1-oxo-1-phenylpropan-2-yl) 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxobutanoate Traditional Name: 4-keto-4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]butyric acid [1-(chloromethyl)-2-keto-2-phenyl-ethyl] ester Formula: C16H16ClN3O4S MolecularWeight: 381.83394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)CCC(=O)OC(CCl)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=NN=C(S1)NC(=O)CCC(=O)OC(CCl)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H16ClN3O4S/c1-10-19-20-16(25-10)18-13(21)7-8-14(22)24-12(9-17)15(23)11-5-3-2-4-6-11/h2-6,12H,7-9H2,1H3,(H,18,20,21)