Vitas-M small molecule compound
2-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK781274
SMILES N#CC1=C(N)OC2=C(C1c1scc(c1)Cn1cnc3c1cccc3)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 C22H18N4O2S MW 402.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O2S/c23-9-14-20(21-17(27)6-3-7-18(21)28-22(14)24)19-8-13(11-29-19)10-26-12-25-15-4-1-2-5-16(15)26/h1-2,4-5,8,11-12,20H,3,6-7,10,24H2InChIKey
HQVRHOXNEXSORB-UHFFFAOYSA-NSynonyms
2amino4(4(1Hbenzimidazol1ylmethyl)thiophen2yl)5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(4(benzimidazol1ylmethyl)thiophen2yl)5oxo4678tetrahydrochromene3carbonitrile
C1CC2=C(C(C(=C(O2)N)C#N)C3=CC(=CS3)CN4C=NC5=CC=CC=C54)C(=O)C1
InChI=1SC22H18N4O2Sc2391420(2117(27)63718(21)2822(14)24)19813(112919)1026122515412516(15)26h12458111220H3671024H2
MFCD06014787
ZINC000004622970
ZINC000004622973
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