Vitas-M small molecule compound
2-amino-1-(2,4-dimethoxyphenyl)-5-oxo-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK761153
SMILES N#CC1=C(N)N(C2=C(C1c1cscc1)C(=O)CCC2)c1ccc(cc1OC)OC
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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 C22H21N3O3S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S/c1-27-14-6-7-16(19(10-14)28-2)25-17-4-3-5-18(26)21(17)20(13-8-9-29-12-13)15(11-23)22(25)24/h6-10,12,20H,3-5,24H2,1-2H3InChIKey
OBZOOKHPAKQGNT-UHFFFAOYSA-NSynonyms
2amino1(24dimethoxyphenyl)5oxo4(thiophen3yl)145678hexahydroquinoline3carbonitrile
2amino1(24dimethoxyphenyl)5oxo4thiophen3yl4678tetrahydroquinoline3carbonitrile
COC1=CC(=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=CSC=C4)C(=O)CCC3)OC
InChI=1SC22H21N3O3Sc127146716(19(1014)282)251743518(26)21(17)20(1389291213)15(1123)22(25)24h6101220H3524H212H3
MFCD01820675
ZINC000000716432
ZINC000000716433
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