Vitas-M small molecule compound
tetramethyl 6'-[(1,3-dioxooctahydro-2H-isoindol-2-yl)acetyl]-5',5',7',9'-tetramethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK043673
SMILES COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1C)C(=O)CN1C(=O)C3C(C1=O)CCCC3)SC(=C(S2)C(=O)OC)C(=O)OC
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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 C36H38N2O11S3 MW 770.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H38N2O11S3/c1-16-13-17(2)24-20(14-16)22-28(35(3,4)38(24)21(39)15-37-29(40)18-11-9-10-12-19(18)30(37)41)50-25(32(43)47-6)23(31(42)46-5)36(22)51-26(33(44)48-7)27(52-36)34(45)49-8/h13-14,18-19H,9-12,15H2,1-8H3InChIKey
GWZNEEXNDWOPME-UHFFFAOYSA-NSynonyms
CC1=CC(=C2C(=C1)C3=C(C(N2C(=O)CN4C(=O)C5CCCCC5C4=O)(C)C)SC(=C(C36SC(=C(S6)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C
COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1C)C(=O)CN1C(=O)C3C(C1=O)CCCC3)SC(=C(S2)C(=O)OC)C(=O)OC
InChI=1SC36H38N2O11S3c1161317(2)2420(1416)2228(35(34)38(24)21(39)153729(40)18119101219(18)30(37)41)5025(32(43)476)23(31(42)465)36(22)5126(33(44)487)27(5236)34(45)498h13141819H91215H218H3
MFCD01859348
STK043673
tetramethyl6((13dioxooctahydro2Hisoindol2yl)acetyl)5579tetramethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2(13dioxo3a45677ahexahydroisoindol2yl)acetyl)5579tetramethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2(13dioxohexahydro1Hisoindol2(3H)yl)acetyl)5579tetramethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000097999624
ZINC000150358468
Check stock
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