N-[6-azanyl-1-butyl-3-methyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]carbothioyl-5-nitro-furan-2-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-3-methyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]carbothioyl-5-nitro-furan-2-carboxamide Openeye Name: N-(6-amino-1-butyl-3-methyl-2,4-dioxo-pyrimidine-5-carbothioyl)-5-nitro-furan-2-carboxamide CAS Name: N-[(6-amino-1-butyl-3-methyl-2,4-dioxo-5-pyrimidinyl)-sulfanylidenemethyl]-5-nitro-2-furancarboxamide IUPAC Name: N-(6-amino-1-butyl-3-methyl-2,4-dioxopyrimidine-5-carbothioyl)-5-nitrofuran-2-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-3-methyl-pyrimidine-5-carbothioyl)-5-nitro-2-furamide Formula: C15H17N5O6S MolecularWeight: 395.39038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)N(C1=O)C)C(=S)NC(=O)C2=CC=C(O2)[N+](=O)[O-])N

Isomeric SMILES

CCCCN1C(=C(C(=O)N(C1=O)C)C(=S)NC(=O)C2=CC=C(O2)[N+](=O)[O-])N

InChI

InChI=1S/C15H17N5O6S/c1-3-4-7-19-11(16)10(14(22)18(2)15(19)23)13(27)17-12(21)8-5-6-9(26-8)20(24)25/h5-6H,3-4,7,16H2,1-2H3,(H,17,21,27)