Vitas-M small molecule compound
ethyl (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK059025
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1ccc(c(c1)OCC)OCCOc1ccc(cc1)C(CC)C)/s2
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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 C38H42N2O7S MW 670.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H42N2O7S/c1-7-24(4)27-11-17-30(18-12-27)46-20-21-47-31-19-10-26(22-32(31)44-8-2)23-33-36(41)40-35(28-13-15-29(43-6)16-14-28)34(37(42)45-9-3)25(5)39-38(40)48-33/h10-19,22-24,35H,7-9,20-21H2,1-6H3/b33-23+InChIKey
MBZXVKYIANTRGS-GZZLJNBRSA-NSynonyms
CCC(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC)C5=CC=C(C=C5)OC)OCC
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(c(c1)OCC)OCCOc1ccc(cc1)C(CC)C)s2
ETHYL(2E)2((4(2(4BUTAN2YLPHENOXY)ETHOXY)3ETHOXYPHENYL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2E)2(4(2(4(BUTAN2YL)PHENOXY)ETHOXY)3ETHOXYBENZYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC38H42N2O7Sc1724(4)27111730(181227)4620214731191026(2232(31)4482)233336(41)4035(28131529(436)161428)34(37(42)4593)25(5)3938(40)4833h1019222435H792021H216H3b3323+
MFCD02017625
STK059025
ZINC000150435091
ZINC000150435104
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