Vitas-M small molecule compound
2-({[(4-chlorobenzyl)sulfanyl]acetyl}amino)-4,5-dimethoxybenzoic acid
Catalog ID
STK061903
SMILES COc1cc(NC(=O)CSCc2ccc(cc2)Cl)c(cc1OC)C(=O)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 C18H18ClNO5S MW 395.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClNO5S/c1-24-15-7-13(18(22)23)14(8-16(15)25-2)20-17(21)10-26-9-11-3-5-12(19)6-4-11/h3-8H,9-10H2,1-2H3,(H,20,21)(H,22,23)InChIKey
QJBZOUJYUMWUAE-UHFFFAOYSA-NSynonyms
2((((4CHLOROBENZYL)SULFANYL)ACETYL)AMINO)45DIMETHOXYBENZOICACID
2((2((4CHLOROPHENYL)METHYLSULFANYL)ACETYL)AMINO)45DIMETHOXYBENZOICACID
COC1=C(C=C(C(=C1)C(=O)O)NC(=O)CSCC2=CC=C(C=C2)Cl)OC
COc1cc(NC(=O)CSCc2ccc(cc2)Cl)c(cc1OC)C(=O)O
InChI=1SC18H18ClNO5Sc12415713(18(22)23)14(816(15)252)2017(21)10269113512(19)6411h38H910H212H3(H2021)(H2223)
MFCD01974492
STK061903
ZINC000001170758
ZINC1170758
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