Vitas-M small molecule compound
N-[2-(5-methoxy-1H-indol-1-yl)ethyl]-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide
Catalog ID
STL475234
SMILES COc1ccc2c(c1)ccn2CCNC(=O)CCCCC1SCC2C1NC(=O)N2
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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 C21H28N4O3S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O3S/c1-28-15-6-7-17-14(12-15)8-10-25(17)11-9-22-19(26)5-3-2-4-18-20-16(13-29-18)23-21(27)24-20/h6-8,10,12,16,18,20H,2-5,9,11,13H2,1H3,(H,22,26)(H2,23,24,27)InChIKey
JTCUIVJWQKJTTH-UHFFFAOYSA-NSynonyms
COC1=CC2=C(C=C1)N(C=C2)CCNC(=O)CCCCC3C4C(CS3)NC(=O)N4
COc1ccc2c(c1)ccn2CCNC(=O)CCCC(C@@H)1SC(C@H)2(C@@H)1NC(=O)N2
InChI=1SC21H28N4O3Sc12815671714(1215)81025(17)1192219(26)5324182016(132918)2321(27)2420h681012161820H2591113H21H3(H2226)(H2232427)
MFCD31751269
N(2(5methoxy1Hindol1yl)ethyl)5((3aS4S6aR)2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
N(2(5methoxy1Hindol1yl)ethyl)5(2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
N(2(5methoxyindol1yl)ethyl)5(2oxo133a466ahexahydrothieno(34d)imidazol4yl)pentanamide
ZINC000096222322
ZINC000334161855
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