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

Systemtic Name: 4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]carbonyl-N-(4-ethoxyphenyl)-2-methyl-piperazine-1-carboxamide Openeye Name: 4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carbonyl]-N-(4-ethoxyphenyl)-2-methyl-piperazine-1-carboxamide CAS Name: 4-[[1-[4-(4-bromophenyl)-2-thiazolyl]-5-ethyl-4-pyrazolyl]-oxomethyl]-N-(4-ethoxyphenyl)-2-methyl-1-piperazinecarboxamide IUPAC Name: 4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethylpyrazole-4-carbonyl]-N-(4-ethoxyphenyl)-2-methylpiperazine-1-carboxamide Traditional Name: 4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carbonyl]-2-methyl-N-p-phenetyl-piperazine-1-carboxamide Formula: C29H31BrN6O3S MolecularWeight: 623.56384

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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=C(C=C5)OCC

Isomeric SMILES

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

InChI

InChI=1S/C29H31BrN6O3S/c1-4-26-24(16-31-36(26)29-33-25(18-40-29)20-6-8-21(30)9-7-20)27(37)34-14-15-35(19(3)17-34)28(38)32-22-10-12-23(13-11-22)39-5-2/h6-13,16,18-19H,4-5,14-15,17H2,1-3H3,(H,32,38)