5-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-N-prop-2-enyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Openeye Name: N-allyl-5-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-methyl-5-nitro-4-imidazolyl)thio]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Traditional Name: allyl-[5-[(3-methyl-5-nitro-imidazol-4-yl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C9H10N6O2S2 MolecularWeight: 298.3447

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NN=C(S2)NCC=C)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NN=C(S2)NCC=C)[N+](=O)[O-]

InChI

InChI=1S/C9H10N6O2S2/c1-3-4-10-8-12-13-9(19-8)18-7-6(15(16)17)11-5-14(7)2/h3,5H,1,4H2,2H3,(H,10,12)