Vitas-M small molecule compound
2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylacetyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Catalog ID
STK137929
SMILES O=C(CC12CC3CC(C2)CC(C1)C3)Nc1sc2c(c1C(=O)N)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 C22H30N2O2S MW 386.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N2O2S/c23-20(26)19-16-4-2-1-3-5-17(16)27-21(19)24-18(25)12-22-9-13-6-14(10-22)8-15(7-13)11-22/h13-15H,1-12H2,(H2,23,26)(H,24,25)InChIKey
WIYREHRIBPHCKI-UHFFFAOYSA-NSynonyms
2((2(1adamantyl)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
2((tricyclo(3311~37~)dec1ylacetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)CC34CC5CC(C3)CC(C5)C4
InChI=1SC22H30N2O2Sc2320(26)19164213517(16)2721(19)2418(25)1222913614(1022)815(713)1122h1315H112H2(H22326)(H2425)
MFCD05795150
ZINC000004681670
ZINC04681670
ZINC4681670
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