Vitas-M small molecule compound
(2Z)-3-[5-(5-chloro-2-methylphenyl)furan-2-yl]-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
Catalog ID
STL505113
SMILES Clc1ccc(c(c1)c1ccc(o1)/C=C(/C(=O)O)\Sc1nnc([nH]1)C)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 C17H14ClN3O3S MW 375.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClN3O3S/c1-9-3-4-11(18)7-13(9)14-6-5-12(24-14)8-15(16(22)23)25-17-19-10(2)20-21-17/h3-8H,1-2H3,(H,22,23)(H,19,20,21)/b15-8-InChIKey
HAQIFVQHRZHBAY-NVNXTCNLSA-NSynonyms
(~(Z))3(5(5chloro2methylphenyl)furan2yl)2((5methyl1~(H)124triazol3yl)sulfanyl)prop2enoicacid
(2Z)3(5(5chloro2methylphenyl)furan2yl)2((5methyl4H124triazol3yl)sulfanyl)prop2enoicacid
(E)3(5(5chloro2methylphenyl)furan2yl)2((5methyl4H124triazol3yl)thio)acrylicacid
(Z)3(5(5CHLORO2METHYLPHENYL)FURAN2YL)2((5METHYL1H124TRIAZOL3YL)SULFANYL)PROP2ENOICACID
1382256
Clc1ccc(c(c1)c1ccc(o1)C=C(C(=O)O)Sc1nnc((nH)1)C)C
InChI=1SC17H14ClN3O3Sc193411(18)713(9)146512(2414)815(16(22)23)25171910(2)202117h38H12H3(H2223)(H192021)b158
MFCD04479663
ZINC000001235525
ZINC1235525
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