N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-4-(4-nitrophenyl)pyrimidin-2-amine

Systemtic Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-4-(4-nitrophenyl)pyrimidin-2-amine Openeye Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-4-(4-nitrophenyl)pyrimidin-2-amine CAS Name: N-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-4-(4-nitrophenyl)-2-pyrimidinamine IUPAC Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-4-(4-nitrophenyl)pyrimidin-2-amine Traditional Name: [4-(4-methylpiperazino)sulfonylphenyl]-[4-(4-nitrophenyl)pyrimidin-2-yl]amine Formula: C21H22N6O4S MolecularWeight: 454.50218

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O4S/c1-25-12-14-26(15-13-25)32(30,31)19-8-4-17(5-9-19)23-21-22-11-10-20(24-21)16-2-6-18(7-3-16)27(28)29/h2-11H,12-15H2,1H3,(H,22,23,24)