4-[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-phenyl]-2-methyl-pyrimidine

Systemtic Name: 4-[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-phenyl]-2-methyl-pyrimidine Openeye Name: 4-[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-phenyl]-2-methyl-pyrimidine CAS Name: 4-[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-2-methylpyrimidine IUPAC Name: 4-[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-2-methylpyrimidine Traditional Name: 4-[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-phenyl]-2-methyl-pyrimidine Formula: C18H14ClN3O4S MolecularWeight: 403.83946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=C(C=C2)[N+](=O)[O-])CS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=C(C=C2)[N+](=O)[O-])CS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H14ClN3O4S/c1-12-20-9-8-17(21-12)13-2-7-18(22(23)24)14(10-13)11-27(25,26)16-5-3-15(19)4-6-16/h2-10H,11H2,1H3