2-azanyl-4-methoxy-N-[1-(phenylmethyl)pyrrolidin-3-yl]pyrimidine-5-carboxamide; ethanedioic acid

Systemtic Name: 2-azanyl-4-methoxy-N-[1-(phenylmethyl)pyrrolidin-3-yl]pyrimidine-5-carboxamide; ethanedioic acid Openeye Name: 2-amino-N-(1-benzylpyrrolidin-3-yl)-4-methoxy-pyrimidine-5-carboxamide; oxalic acid CAS Name: 2-amino-4-methoxy-N-[1-(phenylmethyl)-3-pyrrolidinyl]-5-pyrimidinecarboxamide; oxalic acid IUPAC Name: 2-amino-N-(1-benzylpyrrolidin-3-yl)-4-methoxypyrimidine-5-carboxamide; oxalic acid Traditional Name: 2-amino-N-(1-benzylpyrrolidin-3-yl)-4-methoxy-pyrimidine-5-carboxamide; oxalic acid Formula: C19H23N5O6 MolecularWeight: 417.41582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C(=O)NC2CCN(C2)CC3=CC=CC=C3)N.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=NC(=NC=C1C(=O)NC2CCN(C2)CC3=CC=CC=C3)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H21N5O2.C2H2O4/c1-24-16-14(9-19-17(18)21-16)15(23)20-13-7-8-22(11-13)10-12-5-3-2-4-6-12;3-1(4)2(5)6/h2-6,9,13H,7-8,10-11H2,1H3,(H,20,23)(H2,18,19,21);(H,3,4)(H,5,6)