Vitas-M small molecule compound

(2E)-2-(1,3-benzodioxol-5-ylmethylidene)-7-methyl-3-oxo-N,5-diphenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

Catalog ID
STL327609
SMILES O=C(C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C\c1ccc3c(c1)OCO3)/s2)Nc1ccccc1

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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 C28H21N3O4S MW 495.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N3O4S/c1-17-24(26(32)30-20-10-6-3-7-11-20)25(19-8-4-2-5-9-19)31-27(33)23(36-28(31)29-17)15-18-12-13-21-22(14-18)35-16-34-21/h2-15,25H,16H2,1H3,(H,30,32)/b23-15+
InChIKey
BOOYDGTXVAMSTK-HZHRSRAPSA-N
Synonyms
324072-21-1
(2E)2(13benzodioxol5ylmethylidene)7methyl3oxoN5diphenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
(2E)2(13BENZODIOXOL5YLMETHYLIDENE)7METHYL3OXON5DIPHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
(E)2(benzo(d)(13)dioxol5ylmethylene)7methyl3oxoN5diphenyl35dihydro2Hthiazolo(32a)pyrimidine6carboxamide
2(13BENZODIOXOL5YLMETHYLENE)7METHYL3OXON5DIPHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
324072211
CC1=C(C(N2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=N1)C5=CC=CC=C5)C(=O)NC6=CC=CC=C6
InChI=1SC28H21N3O4Sc11724(26(32)3020106371120)25(198425919)3127(33)23(3628(31)2917)151812132122(1418)35163421h21525H16H21H3(H3032)b2315+
MFCD01072607
O=C(C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc3c(c1)OCO3)s2)Nc1ccccc1
ZINC000006237830
ZINC000032120394

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Available files

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