5-(4-ethoxyphenyl)sulfanyl-1-methyl-4-nitro-imidazole

Systemtic Name: 5-(4-ethoxyphenyl)sulfanyl-1-methyl-4-nitro-imidazole Openeye Name: 5-(4-ethoxyphenyl)sulfanyl-1-methyl-4-nitro-imidazole CAS Name: 5-[(4-ethoxyphenyl)thio]-1-methyl-4-nitroimidazole IUPAC Name: 5-(4-ethoxyphenyl)sulfanyl-1-methyl-4-nitroimidazole Traditional Name: 1-methyl-4-nitro-5-(p-phenetylthio)imidazole Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SC2=C(N=CN2C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)SC2=C(N=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O3S/c1-3-18-9-4-6-10(7-5-9)19-12-11(15(16)17)13-8-14(12)2/h4-8H,3H2,1-2H3