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

Systemtic Name: 4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-N-(1-methylazepan-3-yl)-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(1-methylazepan-3-yl)-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-3-[[(2-chlorophenyl)-oxomethyl]amino]-N-(1-methyl-3-azepanyl)-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(1-methylazepan-3-yl)-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(1-methylazepan-3-yl)-1H-pyrazole-5-carboxamide Formula: C18H21BrClN5O2 MolecularWeight: 454.74864

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC(C1)NC(=O)C2=C(C(=NN2)NC(=O)C3=CC=CC=C3Cl)Br

Isomeric SMILES

CN1CCCCC(C1)NC(=O)C2=C(C(=NN2)NC(=O)C3=CC=CC=C3Cl)Br

InChI

InChI=1S/C18H21BrClN5O2/c1-25-9-5-4-6-11(10-25)21-18(27)15-14(19)16(24-23-15)22-17(26)12-7-2-3-8-13(12)20/h2-3,7-8,11H,4-6,9-10H2,1H3,(H,21,27)(H2,22,23,24,26)