4-methyl-2-[(2-nitrophenyl)methylsulfanyl]-6-phenyl-pyrimidine

Systemtic Name: 4-methyl-2-[(2-nitrophenyl)methylsulfanyl]-6-phenyl-pyrimidine Openeye Name: 4-methyl-2-[(2-nitrophenyl)methylsulfanyl]-6-phenyl-pyrimidine CAS Name: 4-methyl-2-[(2-nitrophenyl)methylthio]-6-phenylpyrimidine IUPAC Name: 4-methyl-2-[(2-nitrophenyl)methylsulfanyl]-6-phenylpyrimidine Traditional Name: 4-methyl-2-[(2-nitrobenzyl)thio]-6-phenyl-pyrimidine Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O2S/c1-13-11-16(14-7-3-2-4-8-14)20-18(19-13)24-12-15-9-5-6-10-17(15)21(22)23/h2-11H,12H2,1H3