Vitas-M small molecule compound
tetramethyl 6'-[(2,5-dioxopyrrolidin-1-yl)acetyl]-8'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK072999
SMILES COc1ccc2c(c1)N(C(=O)CN1C(=O)CCC1=O)C(C1=C2C2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=C(S1)C(=O)OC)C(=O)OC)(C)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 C31H30N2O12S3 MW 718.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2O12S3/c1-30(2)25-20(15-9-8-14(41-3)12-16(15)33(30)19(36)13-32-17(34)10-11-18(32)35)31(21(26(37)42-4)22(46-25)27(38)43-5)47-23(28(39)44-6)24(48-31)29(40)45-7/h8-9,12H,10-11,13H2,1-7H3InChIKey
YLXSEZHZYHVPTN-UHFFFAOYSA-NSynonyms
CC1(C2=C(C3=C(N1C(=O)CN4C(=O)CCC4=O)C=C(C=C3)OC)C5(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S5)C(=O)OC)C(=O)OC)C
COc1ccc2c(c1)N(C(=O)CN1C(=O)CCC1=O)C(C1=C2C2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=C(S1)C(=O)OC)C(=O)OC)(C)C
InChI=1SC31H30N2O12S3c130(2)2520(159814(413)1216(15)33(30)19(36)133217(34)101118(32)35)31(21(26(37)424)22(4625)27(38)435)4723(28(39)446)24(4831)29(40)457h8912H101113H217H3
MFCD01068170
STK072999
tetramethyl6((25dioxopyrrolidin1yl)acetyl)8methoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2(25dioxopyrrolidin1yl)acetyl)8methoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2(25dioxopyrrolidin1yl)acetyl)8methoxy55dimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150363287
ZINC150363287
Check stock
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Check stock on Vitas-MAvailable files
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