Vitas-M small molecule compound

(2E)-2-{3-[(2,4-difluorophenoxy)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
STL175980
SMILES COc1ccc(cc1COc1ccc(cc1F)F)/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 C36H29F2N3O4S MW 637.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H29F2N3O4S/c1-21-9-7-8-12-28(21)40-34(42)32-22(2)39-36-41(33(32)24-10-5-4-6-11-24)35(43)31(46-36)18-23-13-15-29(44-3)25(17-23)20-45-30-16-14-26(37)19-27(30)38/h4-19,33H,20H2,1-3H3,(H,40,42)/b31-18+
InChIKey
SWJWFZLBGBJSGS-FDAWAROLSA-N
Synonyms
512814-56-1
(2E)2((3((24difluorophenoxy)methyl)4methoxyphenyl)methylidene)7methylN(2methylphenyl)3oxo5phenyl5H(13)thiazolo(32a)pyrimidine6carboxamide
(2E)2(3((24difluorophenoxy)methyl)4methoxybenzylidene)7methylN(2methylphenyl)3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
2(3((24DIFLUOROPHENOXY)METHYL)4METHOXYBENZYLIDENE)7METHYLN(2METHYLPHENYL)3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
512814561
CC1=CC=CC=C1NC(=O)C2=C(N=C3N(C2C4=CC=CC=C4)C(=O)C(=CC5=CC(=C(C=C5)OC)COC6=C(C=C(C=C6)F)F)S3)C
COc1ccc(cc1COc1ccc(cc1F)F)C=c1sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)Nc1ccccc1C)C
InChI=1SC36H29F2N3O4Sc1219781228(21)4034(42)3222(2)393641(33(32)24105461124)35(43)31(4636)1823131529(443)25(1723)204530161426(37)1927(30)38h41933H20H213H3(H4042)b3118+
MFCD03466920
ZINC000008455045
ZINC000008455046

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Available files

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