Vitas-M small molecule compound
2-amino-4-(5-tert-butylthiophen-2-yl)-1-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755825
SMILES N#CC1=C(N)N(c2ccc(cc2)C)C2=C(C1c1ccc(s1)C(C)(C)C)C(=O)CCC2
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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 C25H27N3OS MW 417.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3OS/c1-15-8-10-16(11-9-15)28-18-6-5-7-19(29)23(18)22(17(14-26)24(28)27)20-12-13-21(30-20)25(2,3)4/h8-13,22H,5-7,27H2,1-4H3InChIKey
HGRIMCXMBKCEJG-UHFFFAOYSA-NSynonyms
354796-77-32amino4(5tertbutylthiophen2yl)1(4methylphenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino4(5tertbutylthiophen2yl)1(4methylphenyl)5oxo4678tetrahydroquinoline3carbonitrile
354796773
CC1=CC=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=CC=C(S4)C(C)(C)C)C(=O)CCC3
InChI=1SC25H27N3OSc11581016(11915)281865719(29)23(18)22(17(1426)24(28)27)20121321(3020)25(23)4h81322H5727H214H3
MFCD02645608
ZINC000000705441
ZINC000000705442
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