Vitas-M small molecule compound
3-{[4-(pyrrolidin-1-ylsulfonyl)-1,4-diazepan-1-yl]carbonyl}-1H-isothiochromen-1-one
Catalog ID
STL561328
SMILES O=C(c1cc2ccccc2c(=O)s1)N1CCCN(CC1)S(=O)(=O)N1CCCC1
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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 C19H23N3O4S2 MW 421.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O4S2/c23-18(17-14-15-6-1-2-7-16(15)19(24)27-17)20-8-5-11-22(13-12-20)28(25,26)21-9-3-4-10-21/h1-2,6-7,14H,3-5,8-13H2InChIKey
QFDRXLVRNOSSSL-UHFFFAOYSA-NSynonyms
132285369
3((4(pyrrolidin1ylsulfonyl)14diazepan1yl)carbonyl)1Hisothiochromen1one
3(4(pyrrolidin1ylsulfonyl)14diazepane1carbonyl)1Hisothiochromen1one
3(4pyrrolidin1ylsulfonyl14diazepane1carbonyl)isothiochromen1one
InChI=1SC19H23N3O4S2c2318(171415612716(15)19(24)2717)20851122(131220)28(2526)219341021h126714H35813H2
MFCD32262700
ZINC000828147331
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