Vitas-M small molecule compound

ethyl (2Z)-5-[4-(acetyloxy)-3-methoxyphenyl]-7-methyl-2-[1-(4-methylbenzyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK798841
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C\1/C(=O)N(c3c1cccc3)Cc1ccc(cc1)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 C35H31N3O7S MW 637.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H31N3O7S/c1-6-44-34(42)28-20(3)36-35-38(30(28)23-15-16-26(45-21(4)39)27(17-23)43-5)33(41)31(46-35)29-24-9-7-8-10-25(24)37(32(29)40)18-22-13-11-19(2)12-14-22/h7-17,30H,6,18H2,1-5H3/b31-29-
InChIKey
BZITWYLPLGOYCN-YCNYHXFESA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=C1C(=O)N(c3c1cccc3)Cc1ccc(cc1)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)C(=C4C5=CC=CC=C5N(C4=O)CC6=CC=C(C=C6)C)S2)C
ethyl(2Z)5(4(acetyloxy)3methoxyphenyl)7methyl2(1(4methylbenzyl)2oxo12dihydro3Hindol3ylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(4acetyloxy3methoxyphenyl)7methyl2(1((4methylphenyl)methyl)2oxoindol3ylidene)3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC35H31N3O7Sc164434(42)2820(3)363538(30(28)23151626(4521(4)39)27(1723)435)33(41)31(4635)29249781025(24)37(32(29)40)1822131119(2)121422h71730H618H215H3b3129
MFCD03462100
ZINC000097962760
ZINC000097962761

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Available files

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