Vitas-M small molecule compound
2-[(1-methyl-5-nitro-1H-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzoxazole
Catalog ID
STK177431
SMILES [O-][N+](=O)c1nc(nn1C)Sc1nc2c(o1)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C10H7N5O3S MW 277.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H7N5O3S/c1-14-9(15(16)17)12-8(13-14)19-10-11-6-4-2-3-5-7(6)18-10/h2-5H,1H3InChIKey
XLLHQJPLBOTMTM-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1nc(nn1C)Sc1nc2c(o1)cccc2
2((1METHYL5NITRO124TRIAZOL3YL)SULFANYL)13BENZOXAZOLE
2((1METHYL5NITRO1H124TRIAZOL3YL)SULFANYL)13BENZOXAZOLE
3BENZOXAZOL2YLTHIO1METHYL5NITRO124TRIAZOLE
CN1C(=NC(=N1)SC2=NC3=CC=CC=C3O2)(N+)(=O)(O)
InChI=1SC10H7N5O3Sc1149(15(16)17)128(1314)191011642357(6)1810h25H1H3
MFCD04226281
ZINC000001427915
ZINC01427915
ZINC1427915
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