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

Systemtic Name: 4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]carbonyl-N-(3-methoxyphenyl)-2-methyl-piperazine-1-carboxamide Openeye Name: 4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carbonyl]-N-(3-methoxyphenyl)-2-methyl-piperazine-1-carboxamide CAS Name: 4-[[1-[4-(4-bromophenyl)-2-thiazolyl]-5-ethyl-4-pyrazolyl]-oxomethyl]-N-(3-methoxyphenyl)-2-methyl-1-piperazinecarboxamide IUPAC Name: 4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethylpyrazole-4-carbonyl]-N-(3-methoxyphenyl)-2-methylpiperazine-1-carboxamide Traditional Name: 4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carbonyl]-N-(3-methoxyphenyl)-2-methyl-piperazine-1-carboxamide Formula: C28H29BrN6O3S MolecularWeight: 609.53726

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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)OC

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)OC

InChI

InChI=1S/C28H29BrN6O3S/c1-4-25-23(15-30-35(25)28-32-24(17-39-28)19-8-10-20(29)11-9-19)26(36)33-12-13-34(18(2)16-33)27(37)31-21-6-5-7-22(14-21)38-3/h5-11,14-15,17-18H,4,12-13,16H2,1-3H3,(H,31,37)