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

Systemtic Name: [1-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-butan-2-yl] pyridine-3-carboxylate Openeye Name: 1-[[4-(4-bromophenyl)thiazol-2-yl]carbamoyl]propyl pyridine-3-carboxylate CAS Name: 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] pyridine-3-carboxylate Traditional Name: nicotinic acid 1-[[4-(4-bromophenyl)thiazol-2-yl]carbamoyl]propyl ester Formula: C19H16BrN3O3S MolecularWeight: 446.31764

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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=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C19H16BrN3O3S/c1-2-16(26-18(25)13-4-3-9-21-10-13)17(24)23-19-22-15(11-27-19)12-5-7-14(20)8-6-12/h3-11,16H,2H2,1H3,(H,22,23,24)