Vitas-M small molecule compound

(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazol-5-yl]methanone

Catalog ID
STL252182
SMILES O=C(c1sc(nc1C)n1cccc1)N1CCC2(C(C1)CCCC2)O

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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 C18H23N3O2S MW 345.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O2S/c1-13-15(24-17(19-13)20-9-4-5-10-20)16(22)21-11-8-18(23)7-3-2-6-14(18)12-21/h4-5,9-10,14,23H,2-3,6-8,11-12H2,1H3
InChIKey
VGVCXGZPOYQLSB-UHFFFAOYSA-N
Synonyms

((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)(4methyl2(1Hpyrrol1yl)thiazol5yl)methanone
(4ahydroxy13456788aoctahydroisoquinolin2yl)(4methyl2pyrrol1yl13thiazol5yl)methanone
(4ahydroxyoctahydroisoquinolin2(1H)yl)(4methyl2(1Hpyrrol1yl)13thiazol5yl)methanone
CC1=C(SC(=N1)N2C=CC=C2)C(=O)N3CCC4(CCCCC4C3)O
InChI=1SC18H23N3O2Sc11315(2417(1913)209451020)16(22)2111818(23)732614(18)1221h459101423H23681112H21H3
MFCD24852895
O=C(c1sc(nc1C)n1cccc1)N1CC(C@@)2((C@H)(C1)CCCC2)O
ZINC000072404264
ZINC000080338442

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Available files

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