1-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-(3-nitrophenyl)imidazol-2-amine

Systemtic Name: 1-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-(3-nitrophenyl)imidazol-2-amine Openeye Name: 1-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-(3-nitrophenyl)imidazol-2-amine CAS Name: 1-methyl-N-[[4-(methylthio)phenyl]methyl]-5-(3-nitrophenyl)-2-imidazolamine IUPAC Name: 1-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-(3-nitrophenyl)imidazol-2-amine Traditional Name: [1-methyl-5-(3-nitrophenyl)imidazol-2-yl]-[4-(methylthio)benzyl]amine Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1NCC2=CC=C(C=C2)SC)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1NCC2=CC=C(C=C2)SC)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O2S/c1-21-17(14-4-3-5-15(10-14)22(23)24)12-20-18(21)19-11-13-6-8-16(25-2)9-7-13/h3-10,12H,11H2,1-2H3,(H,19,20)