(2S)-2-[(2-bromophenyl)carbonylamino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate

Systemtic Name: (2S)-2-[(2-bromophenyl)carbonylamino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate Openeye Name: (2S)-2-[(2-bromobenzoyl)amino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate CAS Name: (2S)-2-[[(2-bromophenyl)-oxomethyl]amino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate IUPAC Name: (2S)-2-[(2-bromobenzoyl)amino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate Traditional Name: (2S)-2-[(2-bromobenzoyl)amino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butyrimidate Formula: C14H15BrN5O2- MolecularWeight: 365.2052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=NC1=NC=NN1)[O-])NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC(C)[C@@H](C(=NC1=NC=NN1)[O-])NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C14H16BrN5O2/c1-8(2)11(13(22)19-14-16-7-17-20-14)18-12(21)9-5-3-4-6-10(9)15/h3-8,11H,1-2H3,(H,18,21)(H2,16,17,19,20,22)/p-1/t11-/m0/s1