3-(3-methyl-5-nitro-imidazol-4-yl)sulfanylaniline

Systemtic Name: 3-(3-methyl-5-nitro-imidazol-4-yl)sulfanylaniline Openeye Name: 3-(3-methyl-5-nitro-imidazol-4-yl)sulfanylaniline CAS Name: 3-[(3-methyl-5-nitro-4-imidazolyl)thio]aniline IUPAC Name: 3-(3-methyl-5-nitroimidazol-4-yl)sulfanylaniline Traditional Name: [3-[(3-methyl-5-nitro-imidazol-4-yl)thio]phenyl]amine Formula: C10H10N4O2S MolecularWeight: 250.277

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=CC=CC(=C2)N)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=CC=CC(=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C10H10N4O2S/c1-13-6-12-9(14(15)16)10(13)17-8-4-2-3-7(11)5-8/h2-6H,11H2,1H3