Vitas-M small molecule compound
dimethyl 2,2'-[(1,4-dioxobutane-1,4-diyl)diimino]bis(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate)
Catalog ID
STK418455
SMILES COC(=O)c1c(NC(=O)CCC(=O)Nc2sc3c(c2C(=O)OC)CCC(C3)C)sc2c1CCC(C2)C
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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 C26H32N2O6S2 MW 532.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O6S2/c1-13-5-7-15-17(11-13)35-23(21(15)25(31)33-3)27-19(29)9-10-20(30)28-24-22(26(32)34-4)16-8-6-14(2)12-18(16)36-24/h13-14H,5-12H2,1-4H3,(H,27,29)(H,28,30)InChIKey
GFHYAPKOCBZFEU-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CCC(=O)NC3=C(C4=C(S3)CC(CC4)C)C(=O)OC
dimethyl22((14dioxobutane14diyl)diimino)bis(6methyl4567tetrahydro1benzothiophene3carboxylate)
InChI=1SC26H32N2O6S2c113571517(1113)3523(21(15)25(31)333)2719(29)91020(30)282422(26(32)344)168614(2)1218(16)3624h1314H512H214H3(H2729)(H2830)
methyl2((4((3methoxycarbonyl6methyl4567tetrahydro1benzothiophen2yl)amino)4oxobutanoyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD01920833
ZINC000002085665
ZINC000002085668
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