[1-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazol-2-yl]methanamine

Systemtic Name: [1-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazol-2-yl]methanamine Openeye Name: [4-isopropyl-1-methyl-5-(3-nitrophenyl)sulfanyl-imidazol-2-yl]methanamine CAS Name: [1-methyl-5-[(3-nitrophenyl)thio]-4-propan-2-yl-2-imidazolyl]methanamine IUPAC Name: [1-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-ylimidazol-2-yl]methanamine Traditional Name: [4-isopropyl-1-methyl-5-[(3-nitrophenyl)thio]imidazol-2-yl]methylamine Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CN)C)SC2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CN)C)SC2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O2S/c1-9(2)13-14(17(3)12(8-15)16-13)21-11-6-4-5-10(7-11)18(19)20/h4-7,9H,8,15H2,1-3H3