Vitas-M small molecule compound
3-{[(3-methoxyphenyl)carbonyl]amino}phenyl 5-(azepan-1-ylsulfonyl)-2-chlorobenzoate
Catalog ID
STK757646
SMILES COc1cccc(c1)C(=O)Nc1cccc(c1)OC(=O)c1cc(ccc1Cl)S(=O)(=O)N1CCCCCC1
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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 C27H27ClN2O6S MW 543.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN2O6S/c1-35-21-10-6-8-19(16-21)26(31)29-20-9-7-11-22(17-20)36-27(32)24-18-23(12-13-25(24)28)37(33,34)30-14-4-2-3-5-15-30/h6-13,16-18H,2-5,14-15H2,1H3,(H,29,31)InChIKey
AGTURAOZYTWMJQ-UHFFFAOYSA-NSynonyms
(3((3METHOXYBENZOYL)AMINO)PHENYL)5(AZEPAN1YLSULFONYL)2CHLOROBENZOATE
3(((3methoxyphenyl)carbonyl)amino)phenyl5(azepan1ylsulfonyl)2chlorobenzoate
3((3METHOXYPHENYL)CARBONYLAMINO)PHENYL5(AZAPERHYDROEPINYLSULFONYL)2CHLOROBENZOATE
COC1=CC=CC(=C1)C(=O)NC2=CC(=CC=C2)OC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)Cl
InChI=1SC27H27ClN2O6Sc13521106819(1621)26(31)2920971122(1720)3627(32)241823(121325(24)28)37(3334)301442351530h6131618H251415H21H3(H2931)
MFCD01122492
ZINC000000793045
ZINC00793045
ZINC793045
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