Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-[(3-methylthiophen-2-yl)methyl]-3-phenyl-5,6-dihydro-1,4-oxathiine-2-carboxamide
Catalog ID
STK646596
SMILES O=C(C1=C(SCCO1)c1ccccc1)N(C1CCS(=O)(=O)C1)Cc1sccc1C
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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 C21H23NO4S3 MW 449.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO4S3/c1-15-7-10-27-18(15)13-22(17-8-12-29(24,25)14-17)21(23)19-20(28-11-9-26-19)16-5-3-2-4-6-16/h2-7,10,17H,8-9,11-14H2,1H3InChIKey
IWGFWEMJILFWJB-UHFFFAOYSA-NSynonyms
1018165-76-81018165768
CC1=C(SC=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=C(SCCO3)C4=CC=CC=C4
InChI=1SC21H23NO4S3c1157102718(15)1322(1781229(2425)1417)21(23)1920(281192619)165324616h271017H891114H21H3
MFCD12207587
N(11dioxidotetrahydrothiophen3yl)N((3methylthiophen2yl)methyl)3phenyl56dihydro14oxathiine2carboxamide
N(11dioxothiolan3yl)N((3methylthiophen2yl)methyl)5phenyl23dihydro14oxathiine6carboxamide
ZINC000020728582
ZINC000020728586
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