Vitas-M small molecule compound
ethyl (2Z)-2-[(1-benzyl-1H-indol-3-yl)methylidene]-7-methyl-3-oxo-5-[2-(propan-2-yloxy)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL444647
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC(C)C)c(=O)/c(=C/c1cn(c3c1cccc3)Cc1ccccc1)/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 C35H33N3O4S MW 591.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H33N3O4S/c1-5-41-34(40)31-23(4)36-35-38(32(31)27-16-10-12-18-29(27)42-22(2)3)33(39)30(43-35)19-25-21-37(20-24-13-7-6-8-14-24)28-17-11-9-15-26(25)28/h6-19,21-22,32H,5,20H2,1-4H3/b30-19-InChIKey
MFVLKRZTSBYKJV-FSGOGVSDSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC(C)C)c(=O)c(=Cc1cn(c3c1cccc3)Cc1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3OC(C)C)C(=O)C(=CC4=CN(C5=CC=CC=C54)CC6=CC=CC=C6)S2)C
ethyl(2Z)2((1benzyl1Hindol3yl)methylidene)7methyl3oxo5(2(propan2yloxy)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((1BENZYLINDOL3YL)METHYLIDENE)7METHYL3OXO5(2PROPAN2YLOXYPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC35H33N3O4Sc154134(40)3123(4)363538(32(31)271610121829(27)4222(2)3)33(39)30(4335)19252137(2024137681424)28171191526(25)28h619212232H520H214H3b3019
MFCD03166996
ZINC000003772336
ZINC000003772338
Check stock
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Check stock on Vitas-MAvailable files
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