Vitas-M small molecule compound
N-[(2Z)-5-(benzylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenyl-5,6-dihydro-1,4-oxathiine-2-carboxamide 4,4-dioxide
Catalog ID
STK648087
SMILES O=C(C1=C(c2ccccc2)S(=O)(=O)CCO1)/N=c\1/[nH]nc(s1)SCc1ccccc1
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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 C20H17N3O4S3 MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O4S3/c24-18(16-17(15-9-5-2-6-10-15)30(25,26)12-11-27-16)21-19-22-23-20(29-19)28-13-14-7-3-1-4-8-14/h1-10H,11-13H2,(H,21,22,24)InChIKey
OQWRNSLZGXBGSA-UHFFFAOYSA-NSynonyms
1144452-44-7C1CS(=O)(=O)C(=C(O1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)C4=CC=CC=C4
InChI=1SC20H17N3O4S3c2418(1617(1595261015)30(2526)12112716)2119222320(2919)2813147314814h110H1113H2(H212224)
MFCD18164790
N((2Z)5(benzylsulfanyl)134thiadiazol2(3H)ylidene)3phenyl56dihydro14oxathiine2carboxamide44dioxide
N(5benzylsulfanyl134thiadiazol2yl)44dioxo5phenyl23dihydro14oxathiine6carboxamide
O=C(C1=C(c2ccccc2)S(=O)(=O)CCO1)N=c1(nH)nc(s1)SCc1ccccc1
ZINC31819342
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