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

Systemtic Name: 4-bromanyl-5-[(2-chlorophenyl)carbonylamino]-1-pyridin-2-yl-N-[2-(1-pyridin-4-ylpiperidin-4-yl)ethyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-5-[(2-chlorobenzoyl)amino]-1-(2-pyridyl)-N-[2-[1-(4-pyridyl)-4-piperidyl]ethyl]pyrazole-3-carboxamide CAS Name: 4-bromo-5-[[(2-chlorophenyl)-oxomethyl]amino]-1-(2-pyridinyl)-N-[2-(1-pyridin-4-yl-4-piperidinyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-5-[(2-chlorobenzoyl)amino]-1-pyridin-2-yl-N-[2-(1-pyridin-4-ylpiperidin-4-yl)ethyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-5-[(2-chlorobenzoyl)amino]-1-(2-pyridyl)-N-[2-[1-(4-pyridyl)-4-piperidyl]ethyl]pyrazole-3-carboxamide Formula: C28H27BrClN7O2 MolecularWeight: 608.91668

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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=N4)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1CCNC(=O)C2=NN(C(=C2Br)NC(=O)C3=CC=CC=C3Cl)C4=CC=CC=N4)C5=CC=NC=C5

InChI

InChI=1S/C28H27BrClN7O2/c29-24-25(28(39)33-16-8-19-11-17-36(18-12-19)20-9-14-31-15-10-20)35-37(23-7-3-4-13-32-23)26(24)34-27(38)21-5-1-2-6-22(21)30/h1-7,9-10,13-15,19H,8,11-12,16-18H2,(H,33,39)(H,34,38)