N,N,2-trimethyl-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidin-4-amine

Systemtic Name: N,N,2-trimethyl-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidin-4-amine Openeye Name: N,N,2-trimethyl-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidin-4-amine CAS Name: N,N,2-trimethyl-6-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N,N,2-trimethyl-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidin-4-amine Traditional Name: dimethyl-[2-methyl-6-[4-(3-nitrophenyl)sulfonylpiperazino]pyrimidin-4-yl]amine Formula: C17H22N6O4S MolecularWeight: 406.45938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N(C)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CC(=N1)N(C)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H22N6O4S/c1-13-18-16(20(2)3)12-17(19-13)21-7-9-22(10-8-21)28(26,27)15-6-4-5-14(11-15)23(24)25/h4-6,11-12H,7-10H2,1-3H3