Vitas-M small molecule compound
[2-({3-[(4-chlorophenyl)carbamoyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}amino)-2-oxoethoxy]acetic acid
Catalog ID
STK471852
SMILES CC1CCc2c(C1)sc(c2C(=O)Nc1ccc(cc1)Cl)NC(=O)COCC(=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 C20H21ClN2O5S MW 436.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O5S/c1-11-2-7-14-15(8-11)29-20(23-16(24)9-28-10-17(25)26)18(14)19(27)22-13-5-3-12(21)4-6-13/h3-6,11H,2,7-10H2,1H3,(H,22,27)(H,23,24)(H,25,26)InChIKey
RBKVUBIGDCPGIC-UHFFFAOYSA-NSynonyms
(2((3((4chlorophenyl)carbamoyl)6methyl4567tetrahydro1benzothiophen2yl)amino)2oxoethoxy)aceticacid
2(2((3((4chlorophenyl)carbamoyl)6methyl4567tetrahydro1benzothiophen2yl)amino)2oxoethoxy)aceticacid
CC1CCC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)Cl)NC(=O)COCC(=O)O
InChI=1SC20H21ClN2O5Sc111271415(811)2920(2316(24)9281017(25)26)18(14)19(27)22135312(21)4613h3611H2710H21H3(H2227)(H2324)(H2526)
MFCD06031557
ZINC000017100866
ZINC000017100868
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