4-bromanyl-5-[(2-chlorophenyl)carbonylamino]-1-methyl-N-[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-5-[(2-chlorophenyl)carbonylamino]-1-methyl-N-[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-5-[(2-chlorobenzoyl)amino]-1-methyl-N-[4-[4-(4-pyridyl)piperazin-1-yl]phenyl]pyrazole-3-carboxamide CAS Name: 4-bromo-5-[[(2-chlorophenyl)-oxomethyl]amino]-1-methyl-N-[4-(4-pyridin-4-yl-1-piperazinyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-5-[(2-chlorobenzoyl)amino]-1-methyl-N-[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-5-[(2-chlorobenzoyl)amino]-1-methyl-N-[4-[4-(4-pyridyl)piperazino]phenyl]pyrazole-3-carboxamide Formula: C27H25BrClN7O2 MolecularWeight: 594.8901

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C4=CC=NC=C4)Br)NC(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CN1C(=C(C(=N1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C4=CC=NC=C4)Br)NC(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C27H25BrClN7O2/c1-34-25(32-26(37)21-4-2-3-5-22(21)29)23(28)24(33-34)27(38)31-18-6-8-19(9-7-18)35-14-16-36(17-15-35)20-10-12-30-13-11-20/h2-13H,14-17H2,1H3,(H,31,38)(H,32,37)