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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=NC(=CS2)C3=CC(=CC=C3)OC)C(=O)N4CCN(C(C4)C)C(=O)NC5=CC=CC=C5Br

Isomeric SMILES

CCCC1=C(C=NN1C2=NC(=CS2)C3=CC(=CC=C3)OC)C(=O)N4CCN(C(C4)C)C(=O)NC5=CC=CC=C5Br

InChI

InChI=1S/C29H31BrN6O3S/c1-4-8-26-22(16-31-36(26)29-33-25(18-40-29)20-9-7-10-21(15-20)39-3)27(37)34-13-14-35(19(2)17-34)28(38)32-24-12-6-5-11-23(24)30/h5-7,9-12,15-16,18-19H,4,8,13-14,17H2,1-3H3,(H,32,38)