methyl 2-methyl-5-[(2-morpholin-4-ylpyridin-4-yl)methylcarbamoyl]-4-propyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[(2-morpholin-4-ylpyridin-4-yl)methylcarbamoyl]-4-propyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-methyl-5-[(2-morpholino-4-pyridyl)methylcarbamoyl]-4-propyl-1H-pyrrole-3-carboxylate CAS Name: 2-methyl-5-[[[2-(4-morpholinyl)-4-pyridinyl]methylamino]-oxomethyl]-4-propyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(2-morpholin-4-ylpyridin-4-yl)methylcarbamoyl]-4-propyl-1H-pyrrole-3-carboxylate Traditional Name: 2-methyl-5-[(2-morpholino-4-pyridyl)methylcarbamoyl]-4-propyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=C1C(=O)OC)C)C(=O)NCC2=CC(=NC=C2)N3CCOCC3

Isomeric SMILES

CCCC1=C(NC(=C1C(=O)OC)C)C(=O)NCC2=CC(=NC=C2)N3CCOCC3

InChI

InChI=1S/C21H28N4O4/c1-4-5-16-18(21(27)28-3)14(2)24-19(16)20(26)23-13-15-6-7-22-17(12-15)25-8-10-29-11-9-25/h6-7,12,24H,4-5,8-11,13H2,1-3H3,(H,23,26)