Vitas-M small molecule compound
5-chloro-N-{3-[(1,1-dioxidotetrahydrothiophen-3-yl)carbamoyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-3-methyl-1-benzofuran-2-carboxamide
Catalog ID
STK515757
SMILES CC1CCc2c(C1)sc(c2C(=O)NC1CCS(=O)(=O)C1)NC(=O)c1oc2c(c1C)cc(cc2)Cl
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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 C24H25ClN2O5S2 MW 521.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN2O5S2/c1-12-3-5-16-19(9-12)33-24(20(16)22(28)26-15-7-8-34(30,31)11-15)27-23(29)21-13(2)17-10-14(25)4-6-18(17)32-21/h4,6,10,12,15H,3,5,7-9,11H2,1-2H3,(H,26,28)(H,27,29)InChIKey
BFKLEQDAKCRUKM-UHFFFAOYSA-NSynonyms
5chloroN(3((11dioxidotetrahydrothiophen3yl)carbamoyl)6methyl4567tetrahydro1benzothiophen2yl)3methyl1benzofuran2carboxamide
5chloroN(3((11dioxothiolan3yl)carbamoyl)6methyl4567tetrahydro1benzothiophen2yl)3methyl1benzofuran2carboxamide
CC1CCC2=C(C1)SC(=C2C(=O)NC3CCS(=O)(=O)C3)NC(=O)C4=C(C5=C(O4)C=CC(=C5)Cl)C
InChI=1SC24H25ClN2O5S2c112351619(912)3324(20(16)22(28)26157834(3031)1115)2723(29)2113(2)171014(25)4618(17)3221h46101215H357911H212H3(H2628)(H2729)
MFCD05998458
ZINC000001051702
ZINC000016391769
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