Vitas-M small molecule compound
2-{[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide
Catalog ID
STK582464
SMILES COc1cc2CN(CCc2cc1OC)C(=O)CSc1nc2c(o1)ccc(c2)S(=O)(=O)N(C)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 C22H25N3O6S2 MW 491.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O6S2/c1-24(2)33(27,28)16-5-6-18-17(11-16)23-22(31-18)32-13-21(26)25-8-7-14-9-19(29-3)20(30-4)10-15(14)12-25/h5-6,9-11H,7-8,12-13H2,1-4H3InChIKey
QRVXHOUUOGKNAL-UHFFFAOYSA-NSynonyms
883962-77-42((2(67dimethoxy34dihydroisoquinolin2(1H)yl)2oxoethyl)sulfanyl)NNdimethyl13benzoxazole5sulfonamide
2((2(67dimethoxy34dihydroisoquinolin2(1H)yl)2oxoethyl)thio)NNdimethylbenzo(d)oxazole5sulfonamide
2(2(67DIMETHOXY34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)SULFANYLNNDIMETHYL13BENZOXAZOLE5SULFONAMIDE
883962774
CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC
InChI=1SC22H25N3O6S2c124(2)33(2728)16561817(1116)2322(3118)321321(26)258714919(293)20(304)1015(14)1225h56911H781213H214H3
MFCD06791679
ZINC000009429100
ZINC09429100
ZINC9429100
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