Vitas-M small molecule compound

tert-butyl (8Z)-2-amino-8-(4-chlorobenzylidene)-4-(4-chlorophenyl)-3-cyano-7,8-dihydro-4H-pyrano[3,2-c]pyridine-6(5H)-carboxylate

Catalog ID
STK699630
SMILES N#CC1=C(N)OC2=C(C1c1ccc(cc1)Cl)CN(C/C/2=C/c1ccc(cc1)Cl)C(=O)OC(C)(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 C27H25Cl2N3O3 MW 510.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25Cl2N3O3/c1-27(2,3)35-26(33)32-14-18(12-16-4-8-19(28)9-5-16)24-22(15-32)23(21(13-30)25(31)34-24)17-6-10-20(29)11-7-17/h4-12,23H,14-15,31H2,1-3H3/b18-12-
InChIKey
YFWOQBJKRYYPKI-PDGQHHTCSA-N
Synonyms
317840-29-2
(Z)tertbutyl2amino8(4chlorobenzylidene)4(4chlorophenyl)3cyano78dihydro4Hpyrano(32c)pyridine6(5H)carboxylate
317840292
CC(C)(C)OC(=O)N1CC(=CC2=CC=C(C=C2)Cl)C3=C(C1)C(C(=C(O3)N)C#N)C4=CC=C(C=C4)Cl
InChI=1SC27H25Cl2N3O3c127(23)3526(33)321418(12164819(28)9516)2422(1532)23(21(1330)25(31)3424)1761020(29)11717h41223H141531H213H3b1812
MFCD01556173
N#CC1=C(N)OC2=C(C1c1ccc(cc1)Cl)CN(CC2=Cc1ccc(cc1)Cl)C(=O)OC(C)(C)C
tertbutyl(8Z)2amino4(4chlorophenyl)8((4chlorophenyl)methylidene)3cyano57dihydro4Hpyrano(32c)pyridine6carboxylate
tertbutyl(8Z)2amino8(4chlorobenzylidene)4(4chlorophenyl)3cyano78dihydro4Hpyrano(32c)pyridine6(5H)carboxylate
TERTBUTYL2AMINO4(4CHLOROPHENYL)8((4CHLOROPHENYL)METHYLENE)3CYANO567TRIHYDRO4HPYRANO(32C)PYRIDINE6CARBOXYLATE
ZINC000002056345
ZINC000002056347

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Available files

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