Vitas-M small molecule compound
ethyl (2Z)-1,3-diethyl-2-[(2Z)-2-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)ethylidene]-2,3-dihydro-1H-benzimidazole-5-carboxylate
Catalog ID
STK366356
SMILES CCOC(=O)c1ccc2c(c1)n(CC)/c(=C\C=c\1/sc3n(c1=O)c1c(n3)cccc1)/n2CC
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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 C25H24N4O3S MW 460.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O3S/c1-4-27-19-12-11-16(24(31)32-6-3)15-20(19)28(5-2)22(27)14-13-21-23(30)29-18-10-8-7-9-17(18)26-25(29)33-21/h7-15H,4-6H2,1-3H3/b21-13-,22-14-InChIKey
GGPMNLIPZWKYHZ-JZTLMNBPSA-NSynonyms
CCN1C2=C(C=C(C=C2)C(=O)OCC)N(C1=CC=C3C(=O)N4C5=CC=CC=C5N=C4S3)CC
CCOC(=O)c1ccc2c(c1)n(CC)c(=CC=c1sc3n(c1=O)c1c(n3)cccc1)n2CC
ethyl(2Z)13diethyl2((2Z)2(1oxo(13)thiazolo(32a)benzimidazol2ylidene)ethylidene)benzimidazole5carboxylate
ethyl(2Z)13diethyl2((2Z)2(3oxo(13)thiazolo(32a)benzimidazol2(3H)ylidene)ethylidene)23dihydro1Hbenzimidazole5carboxylate
InChI=1SC25H24N4O3Sc142719121116(24(31)3263)1520(19)28(52)22(27)14132123(30)29181087917(18)2625(29)3321h715H46H213H3b21132214
MFCD00327360
ZINC000008653968
ZINC08653968
ZINC8653968
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