Vitas-M small molecule compound
tetramethyl 6'-[(2-chlorophenyl)carbonyl]-9'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK073370
SMILES COc1ccc2c(c1)C1=C(C(N2C(=O)c2ccccc2Cl)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)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 C32H28ClNO10S3 MW 718.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28ClNO10S3/c1-31(2)25-20(17-14-15(40-3)12-13-19(17)34(31)26(35)16-10-8-9-11-18(16)33)32(21(27(36)41-4)22(45-25)28(37)42-5)46-23(29(38)43-6)24(47-32)30(39)44-7/h8-14H,1-7H3InChIKey
KOBGBNSYCMANQK-UHFFFAOYSA-NSynonyms
CC1(C2=C(C3=C(N1C(=O)C4=CC=CC=C4Cl)C=CC(=C3)OC)C5(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S5)C(=O)OC)C(=O)OC)C
COc1ccc2c(c1)C1=C(C(N2C(=O)c2ccccc2Cl)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
InChI=1SC32H28ClNO10S3c131(2)2520(171415(403)121319(17)34(31)26(35)1610891118(16)33)32(21(27(36)414)22(4525)28(37)425)4623(29(38)436)24(4732)30(39)447h814H17H3
MFCD01036808
STK073370
tetramethyl6((2chlorophenyl)carbonyl)9methoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2chlorobenzoyl)9methoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2chlorobenzoyl)9methoxy55dimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150363029
ZINC150363029
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.