Vitas-M small molecule compound
5-oxo-5-{[3-(phenylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino}pentanoic acid
Catalog ID
STK470810
SMILES OC(=O)CCCC(=O)Nc1sc2c(c1C(=O)Nc1ccccc1)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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c24-17(12-7-13-18(25)26)23-21-19(15-10-5-2-6-11-16(15)28-21)20(27)22-14-8-3-1-4-9-14/h1,3-4,8-9H,2,5-7,10-13H2,(H,22,27)(H,23,24)(H,25,26)InChIKey
MMZRDEIFTHURSA-UHFFFAOYSA-NSynonyms
5oxo5((3(phenylcarbamoyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)amino)pentanoicacid
C1CCC2=C(CC1)SC(=C2C(=O)NC3=CC=CC=C3)NC(=O)CCCC(=O)O
InChI=1SC21H24N2O4Sc2417(1271318(25)26)232119(15105261116(15)2821)20(27)22148314914h13489H2571013H2(H2227)(H2324)(H2526)
MFCD06021442
ZINC000017081944
ZINC17081944
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