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

Systemtic Name: (4-bromophenyl) 4-oxidanylidene-4-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]butanoate Openeye Name: (4-bromophenyl) 4-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-4-oxo-butanoate CAS Name: 4-oxo-4-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]butanoic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 4-oxo-4-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]butanoate Traditional Name: 4-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-4-keto-butyric acid (4-bromophenyl) ester Formula: C15H16BrN3O3S MolecularWeight: 398.27484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)CCC(=O)OC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)CCC(=O)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H16BrN3O3S/c1-9(2)14-18-19-15(23-14)17-12(20)7-8-13(21)22-11-5-3-10(16)4-6-11/h3-6,9H,7-8H2,1-2H3,(H,17,19,20)