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

Systemtic Name: 4-[4-(4-chloranyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]-5-[(4-methoxyphenyl)methyl]-2,6-dimethyl-pyrimidine Openeye Name: 4-[4-(4-chloro-3-nitro-phenyl)sulfonylpiperazin-1-yl]-5-[(4-methoxyphenyl)methyl]-2,6-dimethyl-pyrimidine CAS Name: 4-[4-(4-chloro-3-nitrophenyl)sulfonyl-1-piperazinyl]-5-[(4-methoxyphenyl)methyl]-2,6-dimethylpyrimidine IUPAC Name: 4-[4-(4-chloro-3-nitrophenyl)sulfonylpiperazin-1-yl]-5-[(4-methoxyphenyl)methyl]-2,6-dimethylpyrimidine Traditional Name: 4-[4-(4-chloro-3-nitro-phenyl)sulfonylpiperazino]-2,6-dimethyl-5-p-anisyl-pyrimidine Formula: C24H26ClN5O5S MolecularWeight: 532.01174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])CC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H26ClN5O5S/c1-16-21(14-18-4-6-19(35-3)7-5-18)24(27-17(2)26-16)28-10-12-29(13-11-28)36(33,34)20-8-9-22(25)23(15-20)30(31)32/h4-9,15H,10-14H2,1-3H3