Vitas-M small molecule compound
2-amino-1-(3-methylphenyl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755396
SMILES N#CC1=C(N)N(c2cccc(c2)C)C2=C(C1c1cc(OC)c(c(c1)OC)OC)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 C26H27N3O4 MW 445.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O4/c1-15-7-5-8-17(11-15)29-19-9-6-10-20(30)24(19)23(18(14-27)26(29)28)16-12-21(31-2)25(33-4)22(13-16)32-3/h5,7-8,11-13,23H,6,9-10,28H2,1-4H3InChIKey
NWZLHLMOWWNUNU-UHFFFAOYSA-NSynonyms
2amino1(3methylphenyl)5oxo4(345trimethoxyphenyl)145678hexahydroquinoline3carbonitrile
2amino1(3methylphenyl)5oxo4(345trimethoxyphenyl)4678tetrahydroquinoline3carbonitrile
CC1=CC(=CC=C1)N2C3=C(C(C(=C2N)C#N)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)CCC3
InChI=1SC26H27N3O4c11575817(1115)2919961020(30)24(19)23(18(1427)26(29)28)161221(312)25(334)22(1316)323h578111323H691028H214H3
MFCD00827937
ZINC000000705627
ZINC000000705628
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