Vitas-M small molecule compound
3-(3-chlorophenyl)-2-(piperazin-1-yl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK576909
SMILES Clc1cccc(c1)n1c(nc2c(c1=O)c1CCCCCc1s2)N1CCNCC1
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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 C21H23ClN4OS MW 414.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4OS/c22-14-5-4-6-15(13-14)26-20(27)18-16-7-2-1-3-8-17(16)28-19(18)24-21(26)25-11-9-23-10-12-25/h4-6,13,23H,1-3,7-12H2InChIKey
JQLLEKNEKUUEGZ-UHFFFAOYSA-NSynonyms
896845-52-63(3chlorophenyl)2(piperazin1yl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(3chlorophenyl)2(piperazin1yl)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3(3chlorophenyl)2piperazin1yl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
896845526
C1CCC2=C(CC1)SC3=C2C(=O)N(C(=N3)N4CCNCC4)C5=CC(=CC=C5)Cl
InChI=1SC21H23ClN4OSc221454615(1314)2620(27)18167213817(16)2819(18)2421(26)2511923101225h461323H13712H2
MFCD06601783
ZINC000002229826
ZINC2229826
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