methyl 5-[[(2-bromophenyl)carbonylamino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[[(2-bromophenyl)carbonylamino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[[(2-bromobenzoyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[(2-bromophenyl)-oxomethyl]hydrazo]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[(2-bromobenzoyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[(2-bromobenzoyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C16H16BrN3O4 MolecularWeight: 394.21994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NNC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NNC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C16H16BrN3O4/c1-8-12(16(23)24-3)9(2)18-13(8)15(22)20-19-14(21)10-6-4-5-7-11(10)17/h4-7,18H,1-3H3,(H,19,21)(H,20,22)