Vitas-M small molecule compound
3-({(E)-[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}amino)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL369358
SMILES Cc1ccc(cc1C)n1c(C)cc(c1C)/C=N/n1cnc2c(c1=O)c1CCCCc1s2
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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 C25H26N4OS MW 430.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4OS/c1-15-9-10-20(11-16(15)2)29-17(3)12-19(18(29)4)13-27-28-14-26-24-23(25(28)30)21-7-5-6-8-22(21)31-24/h9-14H,5-8H2,1-4H3/b27-13+InChIKey
NRIDPLRUNPLEBB-UVHMKAGCSA-NSynonyms
3(((E)(1(34dimethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)amino)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3((E)(1(34dimethylphenyl)25dimethylpyrrol3yl)methylideneamino)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1=C(C=C(C=C1)N2C(=CC(=C2C)C=NN3C=NC4=C(C3=O)C5=C(S4)CCCC5)C)C
Cc1ccc(cc1C)n1c(C)cc(c1C)C=Nn1cnc2c(c1=O)c1CCCCc1s2
InChI=1SC25H26N4OSc11591020(1116(15)2)2917(3)1219(18(29)4)13272814262423(25(28)30)21756822(21)3124h914H58H214H3b2713+
MFCD04521070
ZINC000015018562
ZINC15224364
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