Vitas-M small molecule compound
dimethyl 5-({[2-(5-methoxy-1H-indol-3-yl)ethyl]carbamothioyl}amino)benzene-1,3-dicarboxylate
Catalog ID
STK206892
SMILES COc1ccc2c(c1)c(CCNC(=S)Nc1cc(cc(c1)C(=O)OC)C(=O)OC)c[nH]2
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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 C22H23N3O5S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S/c1-28-17-4-5-19-18(11-17)13(12-24-19)6-7-23-22(31)25-16-9-14(20(26)29-2)8-15(10-16)21(27)30-3/h4-5,8-12,24H,6-7H2,1-3H3,(H2,23,25,31)InChIKey
OBGDXPHQFJGERC-UHFFFAOYSA-NSynonyms
COC1=CC2=C(C=C1)NC=C2CCNC(=S)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC
COc1ccc2c(c1)c(CCNC(=S)Nc1cc(cc(c1)C(=O)OC)C(=O)OC)c(nH)2
DIMETHYL5(((2(5METHOXY1HINDOL3YL)ETHYL)CARBAMOTHIOYL)AMINO)BENZENE13DICARBOXYLATE
DIMETHYL5(2(5METHOXY1HINDOL3YL)ETHYLCARBAMOTHIOYLAMINO)BENZENE13DICARBOXYLATE
InChI=1SC22H23N3O5Sc12817451918(1117)13(122419)672322(31)2516914(20(26)292)815(1016)21(27)303h4581224H67H213H3(H2232531)
METHYL3(METHOXYCARBONYL)5((((2(5METHOXYINDOL3YL)ETHYL)AMINO)THIOXOMETHYL)AMINO)BENZOATE
MFCD06150077
ZINC000002357366
ZINC02357366
ZINC2357366
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