4-[4-(4-chloranyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]-5,6-dimethyl-2-(4-methylphenyl)pyrimidine

Systemtic Name: 4-[4-(4-chloranyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]-5,6-dimethyl-2-(4-methylphenyl)pyrimidine Openeye Name: 4-[4-(4-chloro-3-nitro-phenyl)sulfonylpiperazin-1-yl]-5,6-dimethyl-2-(p-tolyl)pyrimidine CAS Name: 4-[4-(4-chloro-3-nitrophenyl)sulfonyl-1-piperazinyl]-5,6-dimethyl-2-(4-methylphenyl)pyrimidine IUPAC Name: 4-[4-(4-chloro-3-nitrophenyl)sulfonylpiperazin-1-yl]-5,6-dimethyl-2-(4-methylphenyl)pyrimidine Traditional Name: 4-[4-(4-chloro-3-nitro-phenyl)sulfonylpiperazino]-5,6-dimethyl-2-(p-tolyl)pyrimidine Formula: C23H24ClN5O4S MolecularWeight: 501.98576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C)C

InChI

InChI=1S/C23H24ClN5O4S/c1-15-4-6-18(7-5-15)22-25-17(3)16(2)23(26-22)27-10-12-28(13-11-27)34(32,33)19-8-9-20(24)21(14-19)29(30)31/h4-9,14H,10-13H2,1-3H3