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

Systemtic Name: 4-methyl-2-[(4-nitrophenyl)methylsulfanyl]-6-phenyl-pyrimidine Openeye Name: 4-methyl-2-[(4-nitrophenyl)methylsulfanyl]-6-phenyl-pyrimidine CAS Name: 4-methyl-2-[(4-nitrophenyl)methylthio]-6-phenylpyrimidine IUPAC Name: 4-methyl-2-[(4-nitrophenyl)methylsulfanyl]-6-phenylpyrimidine Traditional Name: 4-methyl-2-[(4-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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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