Vitas-M small molecule compound
methyl (2Z)-2-[4-(dimethylamino)benzylidene]-7-methyl-3-oxo-5-[2-(propan-2-yloxy)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL444658
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccccc1OC(C)C)c(=O)/c(=C/c1ccc(cc1)N(C)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 C27H29N3O4S MW 491.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4S/c1-16(2)34-21-10-8-7-9-20(21)24-23(26(32)33-6)17(3)28-27-30(24)25(31)22(35-27)15-18-11-13-19(14-12-18)29(4)5/h7-16,24H,1-6H3/b22-15-InChIKey
PKRIKUXGMIAAJK-JCMHNJIXSA-NSynonyms
CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)N(C)C)SC2=N1)C4=CC=CC=C4OC(C)C)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccccc1OC(C)C)c(=O)c(=Cc1ccc(cc1)N(C)C)s2
InChI=1SC27H29N3O4Sc116(2)34211087920(21)2423(26(32)336)17(3)282730(24)25(31)22(3527)1518111319(141218)29(4)5h71624H16H3b2215
methyl(2Z)2((4(dimethylamino)phenyl)methylidene)7methyl3oxo5(2propan2yloxyphenyl)5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2Z)2((4DIMETHYLAMINOPHENYL)METHYLIDENE)7METHYL3OXO5(2PROPAN2YLOXYPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2Z)2(4(dimethylamino)benzylidene)7methyl3oxo5(2(propan2yloxy)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD03144280
ZINC000002990666
ZINC000002990668
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