Vitas-M small molecule compound
4-(5-oxo-6,12-dihydro-5H-benzo[b]indeno[1,2-e][1,4]thiazepin-6-yl)phenyl 4-(acetylamino)benzenesulfonate
Catalog ID
STK217836
SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)C1Sc2ccccc2NC2=C1C(=O)c1c2cccc1
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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 C30H22N2O5S2 MW 554.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22N2O5S2/c1-18(33)31-20-12-16-22(17-13-20)39(35,36)37-21-14-10-19(11-15-21)30-27-28(23-6-2-3-7-24(23)29(27)34)32-25-8-4-5-9-26(25)38-30/h2-17,30,32H,1H3,(H,31,33)InChIKey
FEGYJKOGJSLQIM-UHFFFAOYSA-NSynonyms
(4(12oxo511dihydroindeno(21c)(15)benzothiazepin11yl)phenyl)4acetamidobenzenesulfonate
4(12OXO5H11HBENZO(B)INDENO(32E)14THIAZEPIN11YL)PHENYL4(ACETYLAMINO)BENZENESULFONATE
4(5oxo612dihydro5Hbenzo(b)indeno(12e)(14)thiazepin6yl)phenyl4(acetylamino)benzenesulfonate
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C3C4=C(C5=CC=CC=C5C4=O)NC6=CC=CC=C6S3
InChI=1SC30H22N2O5S2c118(33)3120121622(171320)39(3536)3721141019(111521)302728(23623724(23)29(27)34)3225845926(25)3830h2173032H1H3(H3133)
MFCD07181034
ZINC000033356355
ZINC000033356356
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