4-chloranyl-2-(3-methoxy-4-nitro-phenyl)sulfanyl-6-methyl-pyrimidine

Systemtic Name: 4-chloranyl-2-(3-methoxy-4-nitro-phenyl)sulfanyl-6-methyl-pyrimidine Openeye Name: 4-chloro-2-(3-methoxy-4-nitro-phenyl)sulfanyl-6-methyl-pyrimidine CAS Name: 4-chloro-2-[(3-methoxy-4-nitrophenyl)thio]-6-methylpyrimidine IUPAC Name: 4-chloro-2-(3-methoxy-4-nitrophenyl)sulfanyl-6-methylpyrimidine Traditional Name: 4-chloro-2-[(3-methoxy-4-nitro-phenyl)thio]-6-methyl-pyrimidine Formula: C12H10ClN3O3S MolecularWeight: 311.7441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC(=C(C=C2)[N+](=O)[O-])OC)Cl

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC(=C(C=C2)[N+](=O)[O-])OC)Cl

InChI

InChI=1S/C12H10ClN3O3S/c1-7-5-11(13)15-12(14-7)20-8-3-4-9(16(17)18)10(6-8)19-2/h3-6H,1-2H3