4-methoxy-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 4-methoxy-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 4-methoxy-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 4-methoxy-2-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 4-methoxy-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 4-methoxy-2-(4-nosylpiperazino)pyrimidine Formula: C15H17N5O5S MolecularWeight: 379.39098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N5O5S/c1-25-14-6-7-16-15(17-14)18-8-10-19(11-9-18)26(23,24)13-4-2-12(3-5-13)20(21)22/h2-7H,8-11H2,1H3