methyl 6-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-ethyl-carbamoyl]pyridine-2-carboxylate

Systemtic Name: methyl 6-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-ethyl-carbamoyl]pyridine-2-carboxylate Openeye Name: methyl 6-[(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-ethyl-carbamoyl]pyridine-2-carboxylate CAS Name: 6-[[[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-ethylamino]-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-ethylcarbamoyl]pyridine-2-carboxylate Traditional Name: 6-[(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-ethyl-carbamoyl]picolinic acid methyl ester Formula: C21H21N5O5 MolecularWeight: 423.42194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=NC(=CC=C3)C(=O)OC

Isomeric SMILES

CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=NC(=CC=C3)C(=O)OC

InChI

InChI=1S/C21H21N5O5/c1-3-25(19(28)14-10-7-11-15(23-14)20(29)31-2)16-17(22)26(21(30)24-18(16)27)12-13-8-5-4-6-9-13/h4-11H,3,12,22H2,1-2H3,(H,24,27,30)