Vitas-M small molecule compound
2-amino-1-(3,4-dichlorophenyl)-4-{4-methoxy-3-[(2-nitrophenoxy)methyl]phenyl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STL173144
SMILES N#CC1=C(N)N(c2ccc(c(c2)Cl)Cl)C2=C(C1c1ccc(c(c1)COc1ccccc1[N+](=O)[O-])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 C30H24Cl2N4O5 MW 591.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24Cl2N4O5/c1-40-26-12-9-17(13-18(26)16-41-27-8-3-2-5-23(27)36(38)39)28-20(15-33)30(34)35(19-10-11-21(31)22(32)14-19)24-6-4-7-25(37)29(24)28/h2-3,5,8-14,28H,4,6-7,16,34H2,1H3InChIKey
XZHCRZUPGFZBCG-UHFFFAOYSA-NSynonyms
2amino1(34dichlorophenyl)4(4methoxy3((2nitrophenoxy)methyl)phenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino1(34dichlorophenyl)4(4methoxy3((2nitrophenoxy)methyl)phenyl)5oxo4678tetrahydroquinoline3carbonitrile
COC1=C(C=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=C(C=C4)Cl)Cl)N)C#N)COC5=CC=CC=C5(N+)(=O)(O)
InChI=1SC30H24Cl2N4O5c1402612917(1318(26)164127832523(27)36(38)39)2820(1533)30(34)35(19101121(31)22(32)1419)2464725(37)29(24)28h23581428H4671634H21H3
MFCD02242985
N#CC1=C(N)N(c2ccc(c(c2)Cl)Cl)C2=C(C1c1ccc(c(c1)COc1ccccc1(N+)(=O)(O))OC)C(=O)CCC2
ZINC000002109936
ZINC000002109939
Check stock
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