Vitas-M small molecule compound
3-benzyl-2-(4-nitrophenyl)-2,3-dihydro-4H-1,3-benzothiazin-4-one
Catalog ID
STK734027
SMILES O=C1N(Cc2ccccc2)C(Sc2c1cccc2)c1ccc(cc1)[N+](=O)[O-]
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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 C21H16N2O3S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O3S/c24-20-18-8-4-5-9-19(18)27-21(16-10-12-17(13-11-16)23(25)26)22(20)14-15-6-2-1-3-7-15/h1-13,21H,14H2InChIKey
LIROUGBYAOFTDQ-UHFFFAOYSA-NSynonyms
288155-03-3(2R)3BENZYL2(4NITROPHENYL)23DIHYDRO4H13BENZOTHIAZIN4ONE
(2S)3BENZYL2(4NITROPHENYL)23DIHYDRO4H13BENZOTHIAZIN4ONE
2(4NITROPHENYL)3BENZYL2HBENZO(E)13THIAZAPERHYDROIN4ONE
288155033
3benzyl2(4nitrophenyl)23dihydro4H13benzothiazin4one
3BENZYL2(4NITROPHENYL)23DIHYDROBENZO(E)(13)THIAZIN4ONE
3BENZYL2(4NITROPHENYL)2H13BENZOTHIAZIN4ONE
C1=CC=C(C=C1)CN2C(SC3=CC=CC=C3C2=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H16N2O3Sc242018845919(18)2721(16101217(131116)23(25)26)22(20)14156213715h11321H14H2
MFCD01907116
O=C1N(Cc2ccccc2)C(Sc2c1cccc2)c1ccc(cc1)(N+)(=O)(O)
ZINC000001060521
ZINC000001060522
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