Vitas-M small molecule compound
methyl (2Z)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-5-(4-tert-butylphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK794260
SMILES CCCCN1C(=O)/C(=c/2\sc3=NC(=C(C(n3c2=O)c2ccc(cc2)C(C)(C)C)C(=O)OC)C)/c2c1cccc2
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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 C31H33N3O4S MW 543.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O4S/c1-7-8-17-33-22-12-10-9-11-21(22)24(27(33)35)26-28(36)34-25(19-13-15-20(16-14-19)31(3,4)5)23(29(37)38-6)18(2)32-30(34)39-26/h9-16,25H,7-8,17H2,1-6H3/b26-24-InChIKey
IYJLDIQCMXQYMY-LCUIJRPUSA-NSynonyms
(Z)methyl5(4(tertbutyl)phenyl)2(1butyl2oxoindolin3ylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCCCN1C(=O)C(=c2sc3=NC(=C(C(n3c2=O)c2ccc(cc2)C(C)(C)C)C(=O)OC)C)c2c1cccc2
CCCCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OC)C5=CC=C(C=C5)C(C)(C)C)C1=O
InChI=1SC31H33N3O4Sc178173322121091121(22)24(27(33)35)2628(36)3425(19131520(161419)31(34)5)23(29(37)386)18(2)3230(34)3926h91625H7817H216H3b2624
methyl(2Z)2(1butyl2oxo12dihydro3Hindol3ylidene)5(4tertbutylphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2Z)2(1butyl2oxoindol3ylidene)5(4tertbutylphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD01957599
ZINC000100726716
ZINC000100726718
Check stock
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Check stock on Vitas-MAvailable files
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