Vitas-M small molecule compound

2-amino-4-(2-chlorophenyl)-7-methyl-5-oxo-6-(thiophen-2-ylmethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile

Catalog ID
STK166629
SMILES N#CC1=C(N)Oc2c(C1c1ccccc1Cl)c(=O)n(c(c2)C)Cc1cccs1

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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 C21H16ClN3O2S MW 409.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O2S/c1-12-9-17-19(21(26)25(12)11-13-5-4-8-28-13)18(15(10-23)20(24)27-17)14-6-2-3-7-16(14)22/h2-9,18H,11,24H2,1H3
InChIKey
OQSUSNQDBNBYTN-UHFFFAOYSA-N
Synonyms
638138-80-4
(4R)2AMINO4(2CHLOROPHENYL)7METHYL5OXO6(THIOPHEN2YLMETHYL)56DIHYDRO4HPYRANO(32C)PYRIDINE3CARBONITRILE
(4S)2AMINO4(2CHLOROPHENYL)7METHYL5OXO6(THIOPHEN2YLMETHYL)56DIHYDRO4HPYRANO(32C)PYRIDINE3CARBONITRILE
2AMINO4(2CHLOROPHENYL)7METHYL5OXO6(2THIENYLMETHYL)6HYDRO4HPYRANO(32C)PYRIDINE3CARBONITRILE
2AMINO4(2CHLOROPHENYL)7METHYL5OXO6(THIOPHEN2YLMETHYL)4HPYRANO(32C)PYRIDINE3CARBONITRILE
2AMINO4(2CHLOROPHENYL)7METHYL5OXO6(THIOPHEN2YLMETHYL)56DIHYDRO4HPYRANO(32C)PYRIDINE3CARBONITRILE
638138804
CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3Cl)C(=O)N1CC4=CC=CS4
InChI=1SC21H16ClN3O2Sc11291719(21(26)25(12)11135482813)18(15(1023)20(24)2717)14623716(14)22h2918H1124H21H3
MFCD04073236
ZINC000001262881
ZINC000001262882

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.