Vitas-M small molecule compound
2-amino-1-(2-chloropyridin-3-yl)-4-[5-methyl-4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK783460
SMILES N#CC1=C(N)N(C2=C(C1c1sc(c(c1)CN1CCOCC1)C)C(=O)CCC2)c1cccnc1Cl
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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 C25H26ClN5O2S MW 496.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClN5O2S/c1-15-16(14-30-8-10-33-11-9-30)12-21(34-15)22-17(13-27)25(28)31(19-5-3-7-29-24(19)26)18-4-2-6-20(32)23(18)22/h3,5,7,12,22H,2,4,6,8-11,14,28H2,1H3InChIKey
PUCWEYCQEDCJEL-UHFFFAOYSA-NSynonyms
2amino1(2chloropyridin3yl)4(5methyl4(morpholin4ylmethyl)thiophen2yl)5oxo145678hexahydroquinoline3carbonitrile
2amino1(2chloropyridin3yl)4(5methyl4(morpholin4ylmethyl)thiophen2yl)5oxo4678tetrahydroquinoline3carbonitrile
CC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(N=CC=C4)Cl)N)C#N)CN5CCOCC5
InChI=1SC25H26ClN5O2Sc11516(14308103311930)1221(3415)2217(1327)25(28)31(195372924(19)26)1842620(32)23(18)22h3571222H2468111428H21H3
MFCD06618273
ZINC000012372403
ZINC000012372404
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