Vitas-M small molecule compound
3-phenyl-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide 4,4-dioxide
Catalog ID
STK938058
SMILES O=C(C1=C(c2ccccc2)S(=O)(=O)CCO1)NCC(c1cccs1)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 C21H24N2O4S2 MW 432.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S2/c24-21(22-15-17(18-9-6-13-28-18)23-10-4-5-11-23)19-20(16-7-2-1-3-8-16)29(25,26)14-12-27-19/h1-3,6-9,13,17H,4-5,10-12,14-15H2,(H,22,24)InChIKey
MLHMOLCMTQFIFO-UHFFFAOYSA-NSynonyms
3phenylN(2(pyrrolidin1yl)2(thiophen2yl)ethyl)56dihydro14oxathiine2carboxamide44dioxide
3phenylN(2(pyrrolidin1yl)2(thiophen2yl)ethyl)56dihydro14oxathiine2carboxamide44dioxidehydrochloride
44dioxo5phenylN(2pyrrolidin1yl2thiophen2ylethyl)23dihydro14oxathiine6carboxamide
C1CCN(C1)C(CNC(=O)C2=C(S(=O)(=O)CCO2)C3=CC=CC=C3)C4=CC=CS4
InChI=1SC21H24N2O4S2c2421(221517(1896132818)2310451123)1920(167213816)29(2526)14122719h13691317H4510121415H2(H2224)
MFCD13759681
O=C(C1=C(c2ccccc2)S(=O)(=O)CCO1)NCC(c1cccs1)N1CCCC1Cl
ZINC000036360526
ZINC000036360527
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