Vitas-M small molecule compound
methyl (2Z)-5-[4-(acetyloxy)-3-methoxyphenyl]-7-methyl-3-oxo-2-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK799135
SMILES CCCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OC)C)c1ccccc1
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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 C37H34N4O7S MW 678.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H34N4O7S/c1-6-18-47-28-15-12-24(13-16-28)33-26(21-40(39-33)27-10-8-7-9-11-27)20-31-35(43)41-34(32(36(44)46-5)22(2)38-37(41)49-31)25-14-17-29(48-23(3)42)30(19-25)45-4/h7-17,19-21,34H,6,18H2,1-5H3/b31-20-InChIKey
IGINDIJYRBOWEZ-GTWSWNCMSA-NSynonyms
CCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OC)C5=CC(=C(C=C5)OC(=O)C)OC)C6=CC=CC=C6
CCCOc1ccc(cc1)c1nn(cc1C=c1sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OC)C)c1ccccc1
InChI=1SC37H34N4O7Sc16184728151224(131628)3326(2140(3933)27108791127)203135(43)4134(32(36(44)465)22(2)3837(41)4931)25141729(4823(3)42)30(1925)454h717192134H618H215H3b3120
methyl(2Z)5(4(acetyloxy)3methoxyphenyl)7methyl3oxo2((1phenyl3(4propoxyphenyl)1Hpyrazol4yl)methylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2Z)5(4ACETYLOXY3METHOXYPHENYL)7METHYL3OXO2((1PHENYL3(4PROPOXYPHENYL)PYRAZOL4YL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD03462304
ZINC000097957667
ZINC000097957668
Check stock
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Check stock on Vitas-MAvailable files
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