Vitas-M small molecule compound
2-methyl-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-3-nitrobenzamide
Catalog ID
STK074773
SMILES O=C(c1cccc(c1C)[N+](=O)[O-])Nc1nc2c(s1)cc(cc2)S(=O)(=O)C
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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 C16H13N3O5S2 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O5S2/c1-9-11(4-3-5-13(9)19(21)22)15(20)18-16-17-12-7-6-10(26(2,23)24)8-14(12)25-16/h3-8H,1-2H3,(H,17,18,20)InChIKey
MIEXZEZXIWMTKD-UHFFFAOYSA-NSynonyms
349616-37-1(2METHYL3NITROPHENYL)N(6(METHYLSULFONYL)BENZOTHIAZOL2YL)CARBOXAMIDE
2METHYLN((2E)6(METHYLSULFONYL)13BENZOTHIAZOL2(3H)YLIDENE)3NITROBENZAMIDE
2METHYLN(6(METHYLSULFONYL)13BENZOTHIAZOL2YL)3NITROBENZAMIDE
2methylN(6(methylsulfonyl)benzo(d)thiazol2yl)3nitrobenzamide
2METHYLN(6METHYLSULFONYL13BENZOTHIAZOL2YL)3NITROBENZAMIDE
349616371
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C
InChI=1SC16H13N3O5S2c1911(43513(9)19(21)22)15(20)181617127610(26(223)24)814(12)2516h38H12H3(H171820)
MFCD01337308
O=C(c1cccc(c1C)(N+)(=O)(O))Nc1nc2c(s1)cc(cc2)S(=O)(=O)C
STK074773
ZINC09111532
ZINC9111532
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