4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]carbonyl-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]carbonyl-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide Openeye Name: 4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carbonyl]-2-methyl-N-(m-tolyl)piperazine-1-carboxamide CAS Name: 4-[[1-[4-(4-bromophenyl)-2-thiazolyl]-5-ethyl-4-pyrazolyl]-oxomethyl]-2-methyl-N-(3-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethylpyrazole-4-carbonyl]-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carbonyl]-2-methyl-N-(m-tolyl)piperazine-1-carboxamide Formula: C28H29BrN6O2S MolecularWeight: 593.53786

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Br)C(=O)N4CCN(C(C4)C)C(=O)NC5=CC=CC(=C5)C

Isomeric SMILES

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Br)C(=O)N4CCN(C(C4)C)C(=O)NC5=CC=CC(=C5)C

InChI

InChI=1S/C28H29BrN6O2S/c1-4-25-23(15-30-35(25)28-32-24(17-38-28)20-8-10-21(29)11-9-20)26(36)33-12-13-34(19(3)16-33)27(37)31-22-7-5-6-18(2)14-22/h5-11,14-15,17,19H,4,12-13,16H2,1-3H3,(H,31,37)