Vitas-M small molecule compound
ethyl 2-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STK782258
SMILES CCOC(=O)C1=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 C24H23N3O4S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O4S/c1-2-30-24(29)22-21(20-17(28)8-5-9-18(20)31-23(22)25)19-10-14(12-32-19)11-27-13-26-15-6-3-4-7-16(15)27/h3-4,6-7,10,12-13,21H,2,5,8-9,11,25H2,1H3InChIKey
OAGAJRJCCZJYHH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC2=C(C1C3=CC(=CS3)CN4C=NC5=CC=CC=C54)C(=O)CCC2)N
ethyl2amino4(4(1Hbenzimidazol1ylmethyl)thiophen2yl)5oxo5678tetrahydro4Hchromene3carboxylate
ethyl2amino4(4(benzimidazol1ylmethyl)thiophen2yl)5oxo4678tetrahydrochromene3carboxylate
InChI=1SC24H23N3O4Sc123024(29)2221(2017(28)85918(20)3123(22)25)191014(123219)1127132615634716(15)27h346710121321H25891125H21H3
MFCD06017301
ZINC000012412771
ZINC000012412773
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