5-methyl-1-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-[1,2,4]triazolo[4,3-a]quinoline

Systemtic Name: 5-methyl-1-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-[1,2,4]triazolo[4,3-a]quinoline Openeye Name: 5-methyl-1-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-[1,2,4]triazolo[4,3-a]quinoline CAS Name: 5-methyl-1-[(3-methyl-5-nitro-4-imidazolyl)thio]-[1,2,4]triazolo[4,3-a]quinoline IUPAC Name: 5-methyl-1-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-[1,2,4]triazolo[4,3-a]quinoline Traditional Name: 5-methyl-1-[(3-methyl-5-nitro-imidazol-4-yl)thio]-[1,2,4]triazolo[4,3-a]quinoline Formula: C15H12N6O2S MolecularWeight: 340.35978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN=C(N2C3=CC=CC=C13)SC4=C(N=CN4C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=NN=C(N2C3=CC=CC=C13)SC4=C(N=CN4C)[N+](=O)[O-]

InChI

InChI=1S/C15H12N6O2S/c1-9-7-12-17-18-15(20(12)11-6-4-3-5-10(9)11)24-14-13(21(22)23)16-8-19(14)2/h3-8H,1-2H3