Vitas-M small molecule compound
5-{[3-(benzylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino}-5-oxopentanoic acid
Catalog ID
STK471389
SMILES OC(=O)CCCC(=O)Nc1sc2c(c1C(=O)NCc1ccccc1)CCCCC2
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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 C22H26N2O4S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4S/c25-18(12-7-13-19(26)27)24-22-20(16-10-5-2-6-11-17(16)29-22)21(28)23-14-15-8-3-1-4-9-15/h1,3-4,8-9H,2,5-7,10-14H2,(H,23,28)(H,24,25)(H,26,27)InChIKey
SQDJNNHZBLJCFT-UHFFFAOYSA-NSynonyms
5((3(benzylcarbamoyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)amino)5oxopentanoicacid
C1CCC2=C(CC1)SC(=C2C(=O)NCC3=CC=CC=C3)NC(=O)CCCC(=O)O
InChI=1SC22H26N2O4Sc2518(1271319(26)27)242220(16105261117(16)2922)21(28)2314158314915h13489H2571014H2(H2328)(H2425)(H2627)
MFCD06025400
ZINC000017089974
ZINC17089974
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