ethyl 3,5-dimethyl-4-[2-[[(2S)-1-oxidanylbutan-2-yl]amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-[2-[[(2S)-1-oxidanylbutan-2-yl]amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[[(1S)-1-(hydroxymethyl)propyl]amino]pyrimidin-4-yl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[(2S)-1-hydroxybutan-2-yl]amino]-4-pyrimidinyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[(2S)-1-hydroxybutan-2-yl]amino]pyrimidin-4-yl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 3,5-dimethyl-4-[2-[[(1S)-1-methylolpropyl]amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C17H24N4O3 MolecularWeight: 332.39746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC=CC(=N1)C2=C(NC(=C2C)C(=O)OCC)C

Isomeric SMILES

CC[C@@H](CO)NC1=NC=CC(=N1)C2=C(NC(=C2C)C(=O)OCC)C

InChI

InChI=1S/C17H24N4O3/c1-5-12(9-22)20-17-18-8-7-13(21-17)14-10(3)15(19-11(14)4)16(23)24-6-2/h7-8,12,19,22H,5-6,9H2,1-4H3,(H,18,20,21)/t12-/m0/s1