Vitas-M small molecule compound
(2E)-2-{3-[(3-chlorophenoxy)methyl]-4-methoxybenzylidene}-7-methyl-N-(2-methylphenyl)-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL175999
SMILES COc1ccc(cc1COc1cccc(c1)Cl)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)Nc1ccccc1C)C
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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 C36H30ClN3O4S MW 636.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30ClN3O4S/c1-22-10-7-8-15-29(22)39-34(41)32-23(2)38-36-40(33(32)25-11-5-4-6-12-25)35(42)31(45-36)19-24-16-17-30(43-3)26(18-24)21-44-28-14-9-13-27(37)20-28/h4-20,33H,21H2,1-3H3,(H,39,41)/b31-19+InChIKey
ICZCRZANZRXICN-ZCTHSVRISA-NSynonyms
512815-27-9(2E)2((3((3chlorophenoxy)methyl)4methoxyphenyl)methylidene)7methylN(2methylphenyl)3oxo5phenyl5H(13)thiazolo(32a)pyrimidine6carboxamide
(2E)2(3((3chlorophenoxy)methyl)4methoxybenzylidene)7methylN(2methylphenyl)3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
2(3((3CHLOROPHENOXY)METHYL)4METHOXYBENZYLIDENE)7METHYLN(2METHYLPHENYL)3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
512815279
CC1=CC=CC=C1NC(=O)C2=C(N=C3N(C2C4=CC=CC=C4)C(=O)C(=CC5=CC(=C(C=C5)OC)COC6=CC(=CC=C6)Cl)S3)C
COc1ccc(cc1COc1cccc(c1)Cl)C=c1sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)Nc1ccccc1C)C
InChI=1SC36H30ClN3O4Sc12210781529(22)3934(41)3223(2)383640(33(32)25115461225)35(42)31(4536)1924161730(433)26(1824)2144281491327(37)2028h42033H21H213H3(H3941)b3119+
MFCD03467086
ZINC000008455129
ZINC000097959365
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