Vitas-M small molecule compound
ethyl 6-amino-5-cyano-2-({[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}methyl)-4-phenyl-4H-pyran-3-carboxylate
Catalog ID
STK526498
SMILES CCOC(=O)C1=C(CSc2nc3CCN(Cc3c(c2C#N)c2cccs2)C)OC(=C(C1c1ccccc1)C#N)N
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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 C30H27N5O3S2 MW 569.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5O3S2/c1-3-37-30(36)27-23(38-28(33)19(14-31)25(27)18-8-5-4-6-9-18)17-40-29-20(15-32)26(24-10-7-13-39-24)21-16-35(2)12-11-22(21)34-29/h4-10,13,25H,3,11-12,16-17,33H2,1-2H3InChIKey
VLYVIRGVZHSTSD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2)C#N)N)CSC3=NC4=C(CN(CC4)C)C(=C3C#N)C5=CC=CS5
ethyl6amino5cyano2(((3cyano6methyl4(thiophen2yl)5678tetrahydro16naphthyridin2yl)sulfanyl)methyl)4phenyl4Hpyran3carboxylate
ethyl6amino5cyano2(((3cyano6methyl4(thiophen2yl)5678tetrahydro16naphthyridin2yl)thio)methyl)4phenyl4Hpyran3carboxylate
ETHYL6AMINO5CYANO2((3CYANO6METHYL4THIOPHEN2YL78DIHYDRO5H16NAPHTHYRIDIN2YL)SULFANYLMETHYL)4PHENYL4HPYRAN3CARBOXYLATE
InChI=1SC30H27N5O3S2c133730(36)2723(3828(33)19(1431)25(27)188546918)17402920(1532)26(24107133924)211635(2)121122(21)3429h4101325H31112161733H212H3
MFCD00855254
ZINC000053332619
ZINC000053332623
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