Vitas-M small molecule compound
propyl 6-methyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK426182
SMILES CCCOC(=O)c1c(NC(=O)c2cc3ccccc3oc2=O)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 C23H23NO5S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO5S/c1-3-10-28-23(27)19-15-9-8-13(2)11-18(15)30-21(19)24-20(25)16-12-14-6-4-5-7-17(14)29-22(16)26/h4-7,12-13H,3,8-11H2,1-2H3,(H,24,25)InChIKey
XVKMMEHECIIJPU-UHFFFAOYSA-NSynonyms
CCCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC4=CC=CC=C4OC3=O
InChI=1SC23H23NO5Sc13102823(27)19159813(2)1118(15)3021(19)2420(25)161214645717(14)2922(16)26h471213H3811H212H3(H2425)
MFCD01348464
propyl6methyl2(((2oxo2Hchromen3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
propyl6methyl2((2oxochromene3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002768041
ZINC000002768042
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