3-methyl-N-[[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methyl]-5-nitro-imidazol-4-amine

Systemtic Name: 3-methyl-N-[[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methyl]-5-nitro-imidazol-4-amine Openeye Name: 3-methyl-N-[[5-(2-methylthiazol-4-yl)-2-furyl]methyl]-5-nitro-imidazol-4-amine CAS Name: 3-methyl-N-[[5-(2-methyl-4-thiazolyl)-2-furanyl]methyl]-5-nitro-4-imidazolamine IUPAC Name: 3-methyl-N-[[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methyl]-5-nitroimidazol-4-amine Traditional Name: (3-methyl-5-nitro-imidazol-4-yl)-[[5-(2-methylthiazol-4-yl)-2-furyl]methyl]amine Formula: C13H13N5O3S MolecularWeight: 319.33902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(O2)CNC3=C(N=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(O2)CNC3=C(N=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O3S/c1-8-16-10(6-22-8)11-4-3-9(21-11)5-14-12-13(18(19)20)15-7-17(12)2/h3-4,6-7,14H,5H2,1-2H3