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

Systemtic Name: 4-bromanyl-5-[(2-chlorophenyl)carbonylamino]-1-phenyl-N-[2-(1-pyridin-4-ylpiperidin-4-yl)ethyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-5-[(2-chlorobenzoyl)amino]-1-phenyl-N-[2-[1-(4-pyridyl)-4-piperidyl]ethyl]pyrazole-3-carboxamide CAS Name: 4-bromo-5-[[(2-chlorophenyl)-oxomethyl]amino]-1-phenyl-N-[2-(1-pyridin-4-yl-4-piperidinyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-5-[(2-chlorobenzoyl)amino]-1-phenyl-N-[2-(1-pyridin-4-ylpiperidin-4-yl)ethyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-5-[(2-chlorobenzoyl)amino]-1-phenyl-N-[2-[1-(4-pyridyl)-4-piperidyl]ethyl]pyrazole-3-carboxamide Formula: C29H28BrClN6O2 MolecularWeight: 607.92862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCNC(=O)C2=NN(C(=C2Br)NC(=O)C3=CC=CC=C3Cl)C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1CCNC(=O)C2=NN(C(=C2Br)NC(=O)C3=CC=CC=C3Cl)C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C29H28BrClN6O2/c30-25-26(29(39)33-17-10-20-13-18-36(19-14-20)21-11-15-32-16-12-21)35-37(22-6-2-1-3-7-22)27(25)34-28(38)23-8-4-5-9-24(23)31/h1-9,11-12,15-16,20H,10,13-14,17-19H2,(H,33,39)(H,34,38)