Vitas-M small molecule compound
2-[(E)-methoxy-NNO-azoxy]-1-{3-[(4-methylphenyl)sulfonyl]-2-(propan-2-yl)tetrahydropyrimidin-1(2H)-yl}ethanone
Catalog ID
STK277205
SMILES CO/N=[N+](\CC(=O)N1CCCN(C1C(C)C)S(=O)(=O)c1ccc(cc1)C)/[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 C17H26N4O5S MW 398.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H26N4O5S/c1-13(2)17-19(16(22)12-21(23)18-26-4)10-5-11-20(17)27(24,25)15-8-6-14(3)7-9-15/h6-9,13,17H,5,10-12H2,1-4H3/b21-18+InChIKey
ORZDGDIXJWLBBU-DYTRJAOYSA-NSynonyms
(E)methoxyimino(2(3(4methylphenyl)sulfonyl2propan2yl13diazinan1yl)2oxoethyl)oxidoazanium
2((E)methoxyNNOazoxy)1(3((4methylphenyl)sulfonyl)2(propan2yl)tetrahydropyrimidin1(2H)yl)ethanone
CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C2C(C)C)C(=O)C(N+)(=NOC)(O)
CON=(N+)(CC(=O)N1CCCN(C1C(C)C)S(=O)(=O)c1ccc(cc1)C)(O)
InChI=1SC17H26N4O5Sc113(2)1719(16(22)1221(23)18264)1051120(17)27(2425)158614(3)7915h691317H51012H214H3b2118+
MFCD09268840
ZINC000225300414
ZINC000225300450
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