[1-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl] 2-chloranylpyridine-3-carboxylate

Systemtic Name: [1-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl] 2-chloranylpyridine-3-carboxylate Openeye Name: [2-[[4-(4-bromophenyl)thiazol-2-yl]amino]-1-methyl-2-oxo-ethyl] 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid [1-[[4-(4-bromophenyl)-2-thiazolyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-1-oxopropan-2-yl] 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid [2-[[4-(4-bromophenyl)thiazol-2-yl]amino]-2-keto-1-methyl-ethyl] ester Formula: C18H13BrClN3O3S MolecularWeight: 466.73612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)Br)OC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)Br)OC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C18H13BrClN3O3S/c1-10(26-17(25)13-3-2-8-21-15(13)20)16(24)23-18-22-14(9-27-18)11-4-6-12(19)7-5-11/h2-10H,1H3,(H,22,23,24)