Vitas-M small molecule compound
2-amino-4-(5-tert-butylthiophen-2-yl)-7,7-dimethyl-5-oxo-1-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754325
SMILES N#CC1=C(N)N(c2ccccc2)C2=C(C1c1ccc(s1)C(C)(C)C)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 C26H29N3OS MW 431.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3OS/c1-25(2,3)21-12-11-20(31-21)22-17(15-27)24(28)29(16-9-7-6-8-10-16)18-13-26(4,5)14-19(30)23(18)22/h6-12,22H,13-14,28H2,1-5H3InChIKey
VMDFJLUNVWUYJB-UHFFFAOYSA-NSynonyms
311315-61-42amino4(5tertbutylthiophen2yl)77dimethyl5oxo1phenyl145678hexahydroquinoline3carbonitrile
2AMINO4(5TERTBUTYLTHIOPHEN2YL)77DIMETHYL5OXO1PHENYL68DIHYDRO4HQUINOLINE3CARBONITRILE
311315614
CC1(CC2=C(C(C(=C(N2C3=CC=CC=C3)N)C#N)C4=CC=C(S4)C(C)(C)C)C(=O)C1)C
InChI=1SC26H29N3OSc125(23)21121120(3121)2217(1527)24(28)29(1697681016)181326(45)1419(30)23(18)22h61222H131428H215H3
MFCD00825564
ZINC000001435784
ZINC000001435785
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