Vitas-M small molecule compound
2-amino-4-(4-methoxyphenyl)-1-(2-methyl-5-nitrophenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STL174376
SMILES COc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CC(C2)c1ccccc1)c1cc(ccc1C)[N+](=O)[O-])C#N
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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 C30H26N4O4 MW 506.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O4/c1-18-8-11-22(34(36)37)16-25(18)33-26-14-21(19-6-4-3-5-7-19)15-27(35)29(26)28(24(17-31)30(33)32)20-9-12-23(38-2)13-10-20/h3-13,16,21,28H,14-15,32H2,1-2H3InChIKey
ZTDIZNRKNRVPBK-UHFFFAOYSA-NSynonyms
444928-01-22amino4(4methoxyphenyl)1(2methyl5nitrophenyl)5oxo7phenyl145678hexahydroquinoline3carbonitrile
2amino4(4methoxyphenyl)1(2methyl5nitrophenyl)5oxo7phenyl4678tetrahydroquinoline3carbonitrile
444928012
CC1=C(C=C(C=C1)(N+)(=O)(O))N2C3=C(C(C(=C2N)C#N)C4=CC=C(C=C4)OC)C(=O)CC(C3)C5=CC=CC=C5
COc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CC(C2)c1ccccc1)c1cc(ccc1C)(N+)(=O)(O))C#N
InChI=1SC30H26N4O4c11881122(34(36)37)1625(18)33261421(196435719)1527(35)29(26)28(24(1731)30(33)32)2091223(382)131020h313162128H141532H212H3
MFCD02606495
ZINC000000667666
ZINC000000667670
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