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

Systemtic Name: [1-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-butan-2-yl] 2-chloranylpyridine-3-carboxylate Openeye Name: 1-[[4-(4-bromophenyl)thiazol-2-yl]carbamoyl]propyl 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid [1-[[4-(4-bromophenyl)-2-thiazolyl]amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-1-oxobutan-2-yl] 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid 1-[[4-(4-bromophenyl)thiazol-2-yl]carbamoyl]propyl ester Formula: C19H15BrClN3O3S MolecularWeight: 480.7627

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15BrClN3O3S/c1-2-15(27-18(26)13-4-3-9-22-16(13)21)17(25)24-19-23-14(10-28-19)11-5-7-12(20)8-6-11/h3-10,15H,2H2,1H3,(H,23,24,25)