Vitas-M small molecule compound
2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7,7-dimethyl-4-(3-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK761201
SMILES N#CC1=C(N)N(c2sc3c(c2C#N)CCCC3)C2=C(C1c1sccc1C)C(=O)CC(C2)(C)C
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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 C26H26N4OS2 MW 474.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4OS2/c1-14-8-9-32-23(14)21-17(13-28)24(29)30(18-10-26(2,3)11-19(31)22(18)21)25-16(12-27)15-6-4-5-7-20(15)33-25/h8-9,21H,4-7,10-11,29H2,1-3H3InChIKey
LUMAMIGEWHHKHL-UHFFFAOYSA-NSynonyms
2amino1(3cyano4567tetrahydro1benzothiophen2yl)77dimethyl4(3methylthiophen2yl)5oxo145678hexahydroquinoline3carbonitrile
2amino1(3cyano4567tetrahydro1benzothiophen2yl)77dimethyl4(3methylthiophen2yl)5oxo68dihydro4Hquinoline3carbonitrile
CC1=C(SC=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(C5=C(S4)CCCC5)C#N)N)C#N
InChI=1SC26H26N4OS2c114893223(14)2117(1328)24(29)30(181026(23)1119(31)22(18)21)2516(1227)15645720(15)3325h8921H47101129H213H3
MFCD01820785
ZINC000002575537
ZINC000003669829
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