methyl 4-[(4-methyl-2-pyrrolidin-1-yl-pyrimidin-5-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(4-methyl-2-pyrrolidin-1-yl-pyrimidin-5-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(4-methyl-2-pyrrolidin-1-yl-pyrimidine-5-carbonyl)amino]benzoate CAS Name: 4-[[[4-methyl-2-(1-pyrrolidinyl)-5-pyrimidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-methyl-2-pyrrolidin-1-ylpyrimidine-5-carbonyl)amino]benzoate Traditional Name: 4-[(4-methyl-2-pyrrolidino-pyrimidine-5-carbonyl)amino]benzoic acid methyl ester Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC=C(C=C2)C(=O)OC)N3CCCC3

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC=C(C=C2)C(=O)OC)N3CCCC3

InChI

InChI=1S/C18H20N4O3/c1-12-15(11-19-18(20-12)22-9-3-4-10-22)16(23)21-14-7-5-13(6-8-14)17(24)25-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,21,23)