Vitas-M small molecule compound
2,8-dimethyl-5-{[4-(4-nitrophenoxy)phenyl]sulfonyl}-2,3,4,4a,5,9b-hexahydro-1H-pyrido[4,3-b]indole
Catalog ID
STK679394
SMILES CN1CCC2C(C1)c1cc(C)ccc1N2S(=O)(=O)c1ccc(cc1)Oc1ccc(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 C25H25N3O5S MW 479.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5S/c1-17-3-12-24-22(15-17)23-16-26(2)14-13-25(23)27(24)34(31,32)21-10-8-20(9-11-21)33-19-6-4-18(5-7-19)28(29)30/h3-12,15,23,25H,13-14,16H2,1-2H3InChIKey
RXNRGZURASBQFP-UHFFFAOYSA-NSynonyms
28dimethyl5((4(4nitrophenoxy)phenyl)sulfonyl)2344a59bhexahydro1Hpyrido(43b)indole
28DIMETHYL5(4(4NITROPHENOXY)PHENYL)SULFONYL344A9BTETRAHYDRO1HPYRIDO(43B)INDOLE
CC1=CC2=C(C=C1)N(C3C2CN(CC3)C)S(=O)(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)(N+)(=O)(O)
CN1CCC2C(C1)c1cc(C)ccc1N2S(=O)(=O)c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H25N3O5Sc1173122422(1517)231626(2)141325(23)27(24)34(3132)2110820(91121)33196418(5719)28(29)30h312152325H131416H212H3
MFCD03409414
ZINC000006174542
ZINC000104119376
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