N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-cyclopentyl-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-cyclopentyl-4-methoxy-3-nitro-benzamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-cyclopentyl-4-methoxy-3-nitro-benzamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-cyclopentyl-4-methoxy-3-nitrobenzamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-cyclopentyl-4-methoxy-3-nitrobenzamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-cyclopentyl-4-methoxy-3-nitro-benzamide Formula: C24H25N5O6 MolecularWeight: 479.4852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(C2CCCC2)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(C2CCCC2)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N)[N+](=O)[O-]

InChI

InChI=1S/C24H25N5O6/c1-35-19-12-11-16(13-18(19)29(33)34)23(31)28(17-9-5-6-10-17)20-21(25)27(24(32)26-22(20)30)14-15-7-3-2-4-8-15/h2-4,7-8,11-13,17H,5-6,9-10,14,25H2,1H3,(H,26,30,32)