Vitas-M small molecule compound
[2-({3-[(3-methoxyphenyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl}amino)-2-oxoethoxy]acetic acid
Catalog ID
STK470753
SMILES COc1cccc(c1)NC(=O)c1c(NC(=O)COCC(=O)O)sc2c1CCCCC2
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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 C21H24N2O6S MW 432.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O6S/c1-28-14-7-5-6-13(10-14)22-20(27)19-15-8-3-2-4-9-16(15)30-21(19)23-17(24)11-29-12-18(25)26/h5-7,10H,2-4,8-9,11-12H2,1H3,(H,22,27)(H,23,24)(H,25,26)InChIKey
PJKVHDLHEAPIMF-UHFFFAOYSA-NSynonyms
(2((3((3methoxyphenyl)carbamoyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)amino)2oxoethoxy)aceticacid
2(2((3((3methoxyphenyl)carbamoyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)amino)2oxoethoxy)aceticacid
COC1=CC=CC(=C1)NC(=O)C2=C(SC3=C2CCCCC3)NC(=O)COCC(=O)O
InChI=1SC21H24N2O6Sc1281475613(1014)2220(27)19158324916(15)3021(19)2317(24)11291218(25)26h5710H24891112H21H3(H2227)(H2324)(H2526)
MFCD06021405
ZINC000017097943
ZINC17097943
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