[(2-azanyl-4-benzamido-4H-pyrimidin-3-yl)-cyclopentyl-carbamoyl]oxymethyl benzoate

Systemtic Name: [(2-azanyl-4-benzamido-4H-pyrimidin-3-yl)-cyclopentyl-carbamoyl]oxymethyl benzoate Openeye Name: [(2-amino-4-benzamido-4H-pyrimidin-3-yl)-cyclopentyl-carbamoyl]oxymethyl benzoate CAS Name: benzoic acid [[(2-amino-4-benzamido-4H-pyrimidin-3-yl)-cyclopentylamino]-oxomethoxy]methyl ester IUPAC Name: [(2-amino-4-benzamido-4H-pyrimidin-3-yl)-cyclopentylcarbamoyl]oxymethyl benzoate Traditional Name: benzoic acid [(2-amino-4-benzamido-4H-pyrimidin-3-yl)-cyclopentyl-carbamoyl]oxymethyl ester Formula: C25H27N5O5 MolecularWeight: 477.51238

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(C(=O)OCOC(=O)C2=CC=CC=C2)N3C(C=CN=C3N)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)N(C(=O)OCOC(=O)C2=CC=CC=C2)N3C(C=CN=C3N)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27N5O5/c26-24-27-16-15-21(28-22(31)18-9-3-1-4-10-18)30(24)29(20-13-7-8-14-20)25(33)35-17-34-23(32)19-11-5-2-6-12-19/h1-6,9-12,15-16,20-21H,7-8,13-14,17H2,(H2,26,27)(H,28,31)