N-butan-2-yl-2-[4-(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)piperazin-1-yl]ethanamide

Systemtic Name: N-butan-2-yl-2-[4-(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(3-nitro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)piperazin-1-yl]-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[4-(3-nitro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-butan-2-yl-2-[4-(3-nitro-4-oxopyrido[1,2-a]pyrimidin-2-yl)piperazin-1-yl]acetamide Traditional Name: 2-[4-(4-keto-3-nitro-pyrido[1,2-a]pyrimidin-2-yl)piperazino]-N-sec-butyl-acetamide Formula: C18H24N6O4 MolecularWeight: 388.42096

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)CN1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-]

InChI

InChI=1S/C18H24N6O4/c1-3-13(2)19-15(25)12-21-8-10-22(11-9-21)17-16(24(27)28)18(26)23-7-5-4-6-14(23)20-17/h4-7,13H,3,8-12H2,1-2H3,(H,19,25)