Vitas-M small molecule compound
methyl 2-{[3-(4-methoxyphenyl)propanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK421450
SMILES COc1ccc(cc1)CCC(=O)Nc1sc2c(c1C(=O)OC)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 C21H25NO4S MW 387.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO4S/c1-25-15-11-8-14(9-12-15)10-13-18(23)22-20-19(21(24)26-2)16-6-4-3-5-7-17(16)27-20/h8-9,11-12H,3-7,10,13H2,1-2H3,(H,22,23)InChIKey
ORHIMSUTTOLFAN-UHFFFAOYSA-NSynonyms
353786-04-6353786046
COC1=CC=C(C=C1)CCC(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)OC
InChI=1SC21H25NO4Sc1251511814(91215)101318(23)222019(21(24)262)166435717(16)2720h891112H371013H212H3(H2223)
methyl2((3(4methoxyphenyl)propanoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
METHYL2(3(4METHOXYPHENYL)PROPANAMIDO)4H5H6H7H8HCYCLOHEPTA(B)THIOPHENE3CARBOXYLATE
methyl2(3(4methoxyphenyl)propanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01336542
ZINC000003766195
ZINC03766195
ZINC3766195
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