Vitas-M small molecule compound
ethyl (2Z)-2-[3-bromo-4-(dimethylamino)benzylidene]-7-methyl-5-(4-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL484820
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1ccc(c(c1)Br)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 C26H26BrN3O3S MW 540.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrN3O3S/c1-6-33-25(32)22-16(3)28-26-30(23(22)18-10-7-15(2)8-11-18)24(31)21(34-26)14-17-9-12-20(29(4)5)19(27)13-17/h7-14,23H,6H2,1-5H3/b21-14-InChIKey
NSSXDMBTLLEPQO-STZFKDTASA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)c(=Cc1ccc(c(c1)Br)N(C)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=CC(=C(C=C4)N(C)C)Br)S2)C
ETHYL(2Z)2((3BROMO4(DIMETHYLAMINO)PHENYL)METHYLIDENE)7METHYL5(4METHYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(3bromo4(dimethylamino)benzylidene)7methyl5(4methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC26H26BrN3O3Sc163325(32)2216(3)282630(23(22)1810715(2)81118)24(31)21(3426)141791220(29(4)5)19(27)1317h71423H6H215H3b2114
MFCD01140694
ZINC000002918651
ZINC000002918655
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