Vitas-M small molecule compound

ethyl (2Z)-5-[4-(dimethylamino)phenyl]-7-methyl-2-[4-(naphthalen-1-ylmethoxy)benzylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK377532
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C/c1ccc(cc1)OCc1cccc3c1cccc3)/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 C36H33N3O4S MW 603.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H33N3O4S/c1-5-42-35(41)32-23(2)37-36-39(33(32)26-15-17-28(18-16-26)38(3)4)34(40)31(44-36)21-24-13-19-29(20-14-24)43-22-27-11-8-10-25-9-6-7-12-30(25)27/h6-21,33H,5,22H2,1-4H3/b31-21-
InChIKey
WCGMKTNSCOPKIV-YQYKVWLJSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)c(=Cc1ccc(cc1)OCc1cccc3c1cccc3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC=C(C=C4)OCC5=CC=CC6=CC=CC=C65)S2)C
ethyl(2Z)5(4(dimethylamino)phenyl)7methyl2((4(naphthalen1ylmethoxy)phenyl)methylidene)3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(4(dimethylamino)phenyl)7methyl2(4(naphthalen1ylmethoxy)benzylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4DIMETHYLAMINOPHENYL)7METHYL2((4(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC36H33N3O4Sc154235(41)3223(2)373639(33(32)26151728(181626)38(3)4)34(40)31(4436)2124131929(201424)43222711810259671230(25)27h62133H522H214H3b3121
MFCD01592922
ZINC000004046785
ZINC000004046786

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Available files

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