N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-(2-methylpropyl)-5-nitro-furan-2-carboxamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-(2-methylpropyl)-5-nitro-furan-2-carboxamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-isobutyl-5-nitro-furan-2-carboxamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-(2-methylpropyl)-5-nitro-2-furancarboxamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-(2-methylpropyl)-5-nitrofuran-2-carboxamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-5-nitro-2-furamide Formula: C20H21N5O6 MolecularWeight: 427.41064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O6/c1-12(2)10-23(19(27)14-8-9-15(31-14)25(29)30)16-17(21)24(20(28)22-18(16)26)11-13-6-4-3-5-7-13/h3-9,12H,10-11,21H2,1-2H3,(H,22,26,28)