Vitas-M small molecule compound
N-[3-(methylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-phenyl-5,6-dihydro-1,4-oxathiine-2-carboxamide
Catalog ID
STK635238
SMILES CNC(=O)c1c(NC(=O)C2=C(SCCO2)c2ccccc2)sc2c1CCCC2
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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 C21H22N2O3S2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S2/c1-22-19(24)16-14-9-5-6-10-15(14)28-21(16)23-20(25)17-18(27-12-11-26-17)13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-12H2,1H3,(H,22,24)(H,23,25)InChIKey
KQSYPGIRVNDCGX-UHFFFAOYSA-NSynonyms
1010923-14-41010923144
CNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(SCCO3)C4=CC=CC=C4
InChI=1SC21H22N2O3S2c12219(24)16149561015(14)2821(16)2320(25)1718(2712112617)137324813h2478H56912H21H3(H2224)(H2325)
MFCD12199778
N(3(methylcarbamoyl)4567tetrahydro1benzothiophen2yl)3phenyl56dihydro14oxathiine2carboxamide
N(3(methylcarbamoyl)4567tetrahydro1benzothiophen2yl)5phenyl23dihydro14oxathiine6carboxamide
N(3(methylcarbamoyl)4567tetrahydrobenzo(b)thiophen2yl)3phenyl56dihydro14oxathiine2carboxamide
ZINC000012322283
ZINC12322283
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