4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-N-[(2R)-1-(dimethylamino)-1-oxidanylidene-butan-2-yl]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-N-[(2R)-1-(dimethylamino)-1-oxidanylidene-butan-2-yl]-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-[(1R)-1-(dimethylcarbamoyl)propyl]-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-3-[[(2-chlorophenyl)-oxomethyl]amino]-N-[(2R)-1-(dimethylamino)-1-oxobutan-2-yl]-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-[(2R)-1-(dimethylamino)-1-oxobutan-2-yl]-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-[(1R)-1-(dimethylcarbamoyl)propyl]-1H-pyrazole-5-carboxamide Formula: C17H19BrClN5O3 MolecularWeight: 456.72146

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C)C)NC(=O)C1=C(C(=NN1)NC(=O)C2=CC=CC=C2Cl)Br

Isomeric SMILES

CC[C@H](C(=O)N(C)C)NC(=O)C1=C(C(=NN1)NC(=O)C2=CC=CC=C2Cl)Br

InChI

InChI=1S/C17H19BrClN5O3/c1-4-11(17(27)24(2)3)20-16(26)13-12(18)14(23-22-13)21-15(25)9-7-5-6-8-10(9)19/h5-8,11H,4H2,1-3H3,(H,20,26)(H2,21,22,23,25)/t11-/m1/s1