N-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-1H-pyrazole-5-carboxamide Openeye Name: N-[(1S)-2-amino-1-methyl-2-oxo-ethyl]-4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide CAS Name: N-[(2S)-1-amino-1-oxopropan-2-yl]-4-bromo-3-[[(2-chlorophenyl)-oxomethyl]amino]-1H-pyrazole-5-carboxamide IUPAC Name: N-[(2S)-1-amino-1-oxopropan-2-yl]-4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide Traditional Name: N-[(1S)-2-amino-2-keto-1-methyl-ethyl]-4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide Formula: C14H13BrClN5O3 MolecularWeight: 414.64172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrClN5O3/c1-6(11(17)22)18-14(24)10-9(15)12(21-20-10)19-13(23)7-4-2-3-5-8(7)16/h2-6H,1H3,(H2,17,22)(H,18,24)(H2,19,20,21,23)/t6-/m0/s1