ethyl 5-(2-benzamido-4-methyl-1,3-thiazol-5-yl)-1-(4-bromophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(2-benzamido-4-methyl-1,3-thiazol-5-yl)-1-(4-bromophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 5-(2-benzamido-4-methyl-thiazol-5-yl)-1-(4-bromophenyl)pyrazole-3-carboxylate CAS Name: 5-(2-benzamido-4-methyl-5-thiazolyl)-1-(4-bromophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-benzamido-4-methyl-1,3-thiazol-5-yl)-1-(4-bromophenyl)pyrazole-3-carboxylate Traditional Name: 5-(2-benzamido-4-methyl-thiazol-5-yl)-1-(4-bromophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C23H19BrN4O3S MolecularWeight: 511.39096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=C(N=C(S2)NC(=O)C3=CC=CC=C3)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=C(N=C(S2)NC(=O)C3=CC=CC=C3)C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H19BrN4O3S/c1-3-31-22(30)18-13-19(28(27-18)17-11-9-16(24)10-12-17)20-14(2)25-23(32-20)26-21(29)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3,(H,25,26,29)