methyl 6-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-propyl-carbamoyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-propyl-carbamoyl]pyridine-3-carboxylate Openeye Name: methyl 6-[(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-propyl-carbamoyl]pyridine-3-carboxylate CAS Name: 6-[[[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-propylamino]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-propylcarbamoyl]pyridine-3-carboxylate Traditional Name: 6-[(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-propyl-carbamoyl]nicotinic acid methyl ester Formula: C22H23N5O5 MolecularWeight: 437.44852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5O5/c1-3-11-26(20(29)16-10-9-15(12-24-16)21(30)32-2)17-18(23)27(22(31)25-19(17)28)13-14-7-5-4-6-8-14/h4-10,12H,3,11,13,23H2,1-2H3,(H,25,28,31)