2-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-3-nitro-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-3-nitropyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[4-(3-chlorophenyl)sulfonylpiperazino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Formula: C18H16ClN5O5S MolecularWeight: 449.86814

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-])S(=O)(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-])S(=O)(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H16ClN5O5S/c19-13-4-3-5-14(12-13)30(28,29)22-10-8-21(9-11-22)17-16(24(26)27)18(25)23-7-2-1-6-15(23)20-17/h1-7,12H,8-11H2