Vitas-M small molecule compound
2-amino-4-[4-(1H-benzimidazol-1-ylmethyl)-5-methylthiophen-2-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK783326
SMILES N#CC1=C(N)OC2=C(C1c1sc(c(c1)Cn1cnc3c1cccc3)C)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 C23H20N4O2S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O2S/c1-13-14(11-27-12-26-16-5-2-3-6-17(16)27)9-20(30-13)21-15(10-24)23(25)29-19-8-4-7-18(28)22(19)21/h2-3,5-6,9,12,21H,4,7-8,11,25H2,1H3InChIKey
QJTJQARPQDVUFF-UHFFFAOYSA-NSynonyms
2amino4(4(1Hbenzimidazol1ylmethyl)5methylthiophen2yl)5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(4(benzimidazol1ylmethyl)5methylthiophen2yl)5oxo4678tetrahydrochromene3carbonitrile
CC1=C(C=C(S1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)CN4C=NC5=CC=CC=C54
InChI=1SC23H20N4O2Sc11314(1127122616523617(16)27)920(3013)2115(1024)23(25)291984718(28)22(19)21h235691221H4781125H21H3
MFCD06618061
ZINC000004708296
ZINC000004708299
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