Vitas-M small molecule compound
2-[(4-{[(4-ethylphenyl)sulfonyl]amino}-1-hydroxynaphthalen-2-yl)sulfanyl]propanoic acid
Catalog ID
STK696282
SMILES CCc1ccc(cc1)S(=O)(=O)Nc1cc(SC(C(=O)O)C)c(c2c1cccc2)O
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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 C21H21NO5S2 MW 431.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5S2/c1-3-14-8-10-15(11-9-14)29(26,27)22-18-12-19(28-13(2)21(24)25)20(23)17-7-5-4-6-16(17)18/h4-13,22-23H,3H2,1-2H3,(H,24,25)InChIKey
SSNVKVNCGLUBFR-UHFFFAOYSA-NSynonyms
2((4(((4ethylphenyl)sulfonyl)amino)1hydroxynaphthalen2yl)sulfanyl)propanoicacid
2(4((4ethylphenyl)sulfonylamino)1hydroxynaphthalen2yl)sulfanylpropanoicacid
CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC(C)C(=O)O
InChI=1SC21H21NO5S2c131481015(11914)29(2627)22181219(2813(2)21(24)25)20(23)17754616(17)18h4132223H3H212H3(H2425)
MFCD06435250
ZINC000008834635
ZINC000008835917
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