Vitas-M small molecule compound
(2Z)-2-{3-[(4-iodophenoxy)methyl]-4-methoxybenzylidene}-7-methyl-3-oxo-N,5-diphenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL173668
SMILES COc1ccc(cc1COc1ccc(cc1)I)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)Nc1ccccc1)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 C35H28IN3O4S MW 713.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H28IN3O4S/c1-22-31(33(40)38-27-11-7-4-8-12-27)32(24-9-5-3-6-10-24)39-34(41)30(44-35(39)37-22)20-23-13-18-29(42-2)25(19-23)21-43-28-16-14-26(36)15-17-28/h3-20,32H,21H2,1-2H3,(H,38,40)/b30-20-InChIKey
UOCZIVPZJCTVCR-COEJQBHMSA-NSynonyms
445244-85-9(2Z)2((3((4IODOPHENOXY)METHYL)4METHOXYPHENYL)METHYLIDENE)7METHYL3OXON5DIPHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
(2Z)2(3((4iodophenoxy)methyl)4methoxybenzylidene)7methyl3oxoN5diphenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
2(3((4IODOPHENOXY)METHYL)4METHOXYBENZYLIDENE)7METHYL3OXON5DIPHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
445244859
CC1=C(C(N2C(=O)C(=CC3=CC(=C(C=C3)OC)COC4=CC=C(C=C4)I)SC2=N1)C5=CC=CC=C5)C(=O)NC6=CC=CC=C6
COc1ccc(cc1COc1ccc(cc1)I)C=c1sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)Nc1ccccc1)C
InChI=1SC35H28IN3O4Sc12231(33(40)3827117481227)32(2495361024)3934(41)30(4435(39)3722)2023131829(422)25(1923)214328161426(36)151728h32032H21H212H3(H3840)b3020
MFCD02243380
ZINC000008454740
ZINC000008454741
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