methyl 5-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-[4-(5-bromo-2-pyridyl)piperazin-1-yl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[4-(5-bromopyridin-2-yl)piperazin-1-yl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[4-(5-bromo-2-pyridyl)piperazino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C19H23BrN4O3 MolecularWeight: 435.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2CCN(CC2)C3=NC=C(C=C3)Br

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2CCN(CC2)C3=NC=C(C=C3)Br

InChI

InChI=1S/C19H23BrN4O3/c1-12-17(19(26)27-3)13(2)22-18(12)15(25)11-23-6-8-24(9-7-23)16-5-4-14(20)10-21-16/h4-5,10,22H,6-9,11H2,1-3H3