4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[4-(4-bromophenyl)thiazol-2-yl]amino]-4-oxo-butanoate CAS Name: 4-[[4-(4-bromophenyl)-2-thiazolyl]amino]-4-oxobutanoate IUPAC Name: 4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[4-(4-bromophenyl)thiazol-2-yl]amino]-4-keto-butyrate Formula: C13H10BrN2O3S- MolecularWeight: 354.1991

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)CCC(=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)CCC(=O)[O-])Br

InChI

InChI=1S/C13H11BrN2O3S/c14-9-3-1-8(2-4-9)10-7-20-13(15-10)16-11(17)5-6-12(18)19/h1-4,7H,5-6H2,(H,18,19)(H,15,16,17)/p-1