3-((1-METHYL-4-NITRO-5-IMIDAZOLYL)THIO)-1H-1,2,4-TRIAZOLE

CAS No.
91300-62-8
CCD No.
CCD00239042
Formula
C6 H6 N6 O2 S
MolWeight
226.219

Basic Information

Product Name: 3-((1-METHYL-4-NITRO-5-IMIDAZOLYL)THIO)-1H-1,2,4-TRIAZOLE
CAS: 91300-62-8
English Synonyms: 3-((1-METHYL-4-NITRO-5-IMIDAZOLYL)THIO)-1H-1,2,4-TRIAZOLE
MDL Number.: MFCD01678593
H bond acceptor: 8
H bond donor: 1
Smile: Cn1cnc(c1Sc2nc[nH]n2)[N+](=O)[O-]
InChi: InChI=1S/C6H6N6O2S/c1-11-3-8-4(12(13)14)5(11)15-6-7-2-9-10-6/h2-3H,1H3,(H,7,9,10)
InChiKey: InChIKey=YUPUITJUYVPDSP-UHFFFAOYSA-N

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