4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-N-[1-(phenylmethyl)pyrrolidin-3-yl]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-N-[1-(phenylmethyl)pyrrolidin-3-yl]-1H-pyrazole-5-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-3-[[(2-chlorophenyl)-oxomethyl]amino]-N-[1-(phenylmethyl)-3-pyrrolidinyl]-1H-pyrazole-5-carboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide Formula: C22H21BrClN5O2 MolecularWeight: 502.79144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=C(C(=NN2)NC(=O)C3=CC=CC=C3Cl)Br)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC1NC(=O)C2=C(C(=NN2)NC(=O)C3=CC=CC=C3Cl)Br)CC4=CC=CC=C4

InChI

InChI=1S/C22H21BrClN5O2/c23-18-19(27-28-20(18)26-21(30)16-8-4-5-9-17(16)24)22(31)25-15-10-11-29(13-15)12-14-6-2-1-3-7-14/h1-9,15H,10-13H2,(H,25,31)(H2,26,27,28,30)