Vitas-M small molecule compound
methyl (2Z)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-(1-heptyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798144
SMILES CCCCCCCN1c2ccccc2/C(=c\2/sc3=NC(=C(C(n3c2=O)c2ccc(c(c2)OC)OC(=O)C)C(=O)OC)C)/C1=O
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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 C33H35N3O7S MW 617.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35N3O7S/c1-6-7-8-9-12-17-35-23-14-11-10-13-22(23)27(30(35)38)29-31(39)36-28(26(32(40)42-5)19(2)34-33(36)44-29)21-15-16-24(43-20(3)37)25(18-21)41-4/h10-11,13-16,18,28H,6-9,12,17H2,1-5H3/b29-27-InChIKey
CMWDBPWAMZXGIF-OHYPFYFLSA-NSynonyms
CCCCCCCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OC)C5=CC(=C(C=C5)OC(=O)C)OC)C1=O
CCCCCCCN1c2ccccc2C(=c2sc3=NC(=C(C(n3c2=O)c2ccc(c(c2)OC)OC(=O)C)C(=O)OC)C)C1=O
InChI=1SC33H35N3O7Sc16789121735231411101322(23)27(30(35)38)2931(39)3628(26(32(40)425)19(2)3433(36)4429)21151624(4320(3)37)25(1821)414h101113161828H691217H215H3b2927
methyl(2Z)5(4(acetyloxy)3methoxyphenyl)2(1heptyl2oxo12dihydro3Hindol3ylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2Z)5(4acetyloxy3methoxyphenyl)2(1heptyl2oxoindol3ylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD03417556
ZINC000100838319
ZINC000100838320
Check stock
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Check stock on Vitas-MAvailable files
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