1-butyl-2-(4-nitrophenyl)sulfanyl-imidazole

Systemtic Name: 1-butyl-2-(4-nitrophenyl)sulfanyl-imidazole Openeye Name: 1-butyl-2-(4-nitrophenyl)sulfanyl-imidazole CAS Name: 1-butyl-2-[(4-nitrophenyl)thio]imidazole IUPAC Name: 1-butyl-2-(4-nitrophenyl)sulfanylimidazole Traditional Name: 1-butyl-2-[(4-nitrophenyl)thio]imidazole Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CN=C1SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C=CN=C1SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O2S/c1-2-3-9-15-10-8-14-13(15)19-12-6-4-11(5-7-12)16(17)18/h4-8,10H,2-3,9H2,1H3