N-(4-methylsulfonylphenyl)-5-nitro-6-(1-propylsulfonylpiperidin-4-yl)oxy-pyrimidin-4-amine

Systemtic Name: N-(4-methylsulfonylphenyl)-5-nitro-6-(1-propylsulfonylpiperidin-4-yl)oxy-pyrimidin-4-amine Openeye Name: N-(4-methylsulfonylphenyl)-5-nitro-6-[(1-propylsulfonyl-4-piperidyl)oxy]pyrimidin-4-amine CAS Name: N-(4-methylsulfonylphenyl)-5-nitro-6-[(1-propylsulfonyl-4-piperidinyl)oxy]-4-pyrimidinamine IUPAC Name: N-(4-methylsulfonylphenyl)-5-nitro-6-(1-propylsulfonylpiperidin-4-yl)oxypyrimidin-4-amine Traditional Name: (4-mesylphenyl)-[5-nitro-6-[(1-propylsulfonyl-4-piperidyl)oxy]pyrimidin-4-yl]amine Formula: C19H25N5O7S2 MolecularWeight: 499.5611

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C19H25N5O7S2/c1-3-12-33(29,30)23-10-8-15(9-11-23)31-19-17(24(25)26)18(20-13-21-19)22-14-4-6-16(7-5-14)32(2,27)28/h4-7,13,15H,3,8-12H2,1-2H3,(H,20,21,22)