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

Systemtic Name: 4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-N-(1-methyl-2-oxidanylidene-azepan-3-yl)-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(1-methyl-2-oxo-azepan-3-yl)-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-3-[[(2-chlorophenyl)-oxomethyl]amino]-N-(1-methyl-2-oxo-3-azepanyl)-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(1-methyl-2-oxoazepan-3-yl)-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(2-keto-1-methyl-azepan-3-yl)-1H-pyrazole-5-carboxamide Formula: C18H19BrClN5O3 MolecularWeight: 468.73216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrClN5O3/c1-25-9-5-4-8-12(18(25)28)21-17(27)14-13(19)15(24-23-14)22-16(26)10-6-2-3-7-11(10)20/h2-3,6-7,12H,4-5,8-9H2,1H3,(H,21,27)(H2,22,23,24,26)