Vitas-M small molecule compound
N-[5-({3-[(2,5-dimethylphenyl)amino]-3-oxopropyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide
Catalog ID
STK328422
SMILES O=C(Nc1nnc(s1)SCCC(=O)Nc1cc(C)ccc1C)CCN1C(=O)c2c(S1(=O)=O)cccc2
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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 C23H23N5O5S3 MW 545.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O5S3/c1-14-7-8-15(2)17(13-14)24-20(30)10-12-34-23-27-26-22(35-23)25-19(29)9-11-28-21(31)16-5-3-4-6-18(16)36(28,32)33/h3-8,13H,9-12H2,1-2H3,(H,24,30)(H,25,26,29)InChIKey
UKAGFKMFTSYRIB-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)C)NC(=O)CCSC2=NN=C(S2)NC(=O)CCN3C(=O)C4=CC=CC=C4S3(=O)=O
InChI=1SC23H23N5O5S3c1147815(2)17(1314)2420(30)10123423272622(3523)2519(29)9112821(31)16534618(16)36(2832)33h3813H912H212H3(H2430)(H252629)
MFCD07620420
N(5((3((25dimethylphenyl)amino)3oxopropyl)sulfanyl)134thiadiazol2yl)3(11dioxido3oxo12benzothiazol2(3H)yl)propanamide
N(5(3(25dimethylanilino)3oxopropyl)sulfanyl134thiadiazol2yl)3(113trioxo12benzothiazol2yl)propanamide
ZINC000097994909
ZINC97994909
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