Vitas-M small molecule compound
ethyl (2Z)-7-methyl-2-{[1-(3-methylbenzyl)-1H-indol-3-yl]methylidene}-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK085957
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1cn(c3c1cccc3)Cc1cccc(c1)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 C33H29N3O3S MW 547.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29N3O3S/c1-4-39-32(38)29-22(3)34-33-36(30(29)24-13-6-5-7-14-24)31(37)28(40-33)18-25-20-35(27-16-9-8-15-26(25)27)19-23-12-10-11-21(2)17-23/h5-18,20,30H,4,19H2,1-3H3/b28-18-InChIKey
IEPRVHYYYRFVDR-VEILYXNESA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1cn(c3c1cccc3)Cc1cccc(c1)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CN(C5=CC=CC=C54)CC6=CC=CC(=C6)C)S2)C
ETHYL(2Z)7METHYL2((1((3METHYLPHENYL)METHYL)INDOL3YL)METHYLIDENE)3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)7METHYL2((1(3METHYLBENZYL)1HINDOL3YL)METHYLIDENE)3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC33H29N3O3Sc143932(38)2922(3)343336(30(29)24136571424)31(37)28(4033)18252035(2716981526(25)27)192312101121(2)1723h5182030H419H213H3b2818
MFCD03033141
STK085957
ZINC000097959135
ZINC000097959136
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Check stock on Vitas-MAvailable files
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