2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-5-nitro-pyrimidin-4-amine

Systemtic Name: 2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-5-nitro-pyrimidin-4-amine Openeye Name: 2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-5-nitro-pyrimidin-4-amine CAS Name: 2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-5-nitro-4-pyrimidinamine IUPAC Name: 2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-5-nitropyrimidin-4-amine Traditional Name: [2-[4-(4-methoxyphenyl)sulfonylpiperazino]-5-nitro-pyrimidin-4-yl]amine Formula: C15H18N6O5S MolecularWeight: 394.40562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=C(C(=N3)N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=C(C(=N3)N)[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O5S/c1-26-11-2-4-12(5-3-11)27(24,25)20-8-6-19(7-9-20)15-17-10-13(21(22)23)14(16)18-15/h2-5,10H,6-9H2,1H3,(H2,16,17,18)