Vitas-M small molecule compound
2-amino-1-(dimethylamino)-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK774643
SMILES N#CC1=C(N)N(N(C)C)C2=C(C1c1sc3c(c1C)cccc3)C(=O)CC(C2)c1ccccc1
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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 C27H26N4OS MW 454.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4OS/c1-16-19-11-7-8-12-23(19)33-26(16)24-20(15-28)27(29)31(30(2)3)21-13-18(14-22(32)25(21)24)17-9-5-4-6-10-17/h4-12,18,24H,13-14,29H2,1-3H3InChIKey
HXKXITZSPJSTAR-UHFFFAOYSA-NSynonyms
2amino1(dimethylamino)4(3methyl1benzothiophen2yl)5oxo7phenyl145678hexahydroquinoline3carbonitrile
2amino1(dimethylamino)4(3methyl1benzothiophen2yl)5oxo7phenyl4678tetrahydroquinoline3carbonitrile
CC1=C(SC2=CC=CC=C12)C3C(=C(N(C4=C3C(=O)CC(C4)C5=CC=CC=C5)N(C)C)N)C#N
InChI=1SC27H26N4OSc1161911781223(19)3326(16)2420(1528)27(29)31(30(2)3)211318(1422(32)25(21)24)1795461017h4121824H131429H213H3
MFCD04061076
ZINC000001446006
ZINC000001446009
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