Vitas-M small molecule compound

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

Catalog ID
STK833276
SMILES COC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1ccc(cc1)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 C22H21N3O3S2 MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S2/c1-13-18(21(27)28-4)19(16-6-5-11-29-16)25-20(26)17(30-22(25)23-13)12-14-7-9-15(10-8-14)24(2)3/h5-12,19H,1-4H3/b17-12-
InChIKey
AEDJTNAZBMBZFL-ATVHPVEESA-N
Synonyms

(Z)methyl2(4(dimethylamino)benzylidene)7methyl3oxo5(thiophen2yl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)N(C)C)SC2=N1)C4=CC=CS4)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1ccc(cc1)N(C)C)s2
InChI=1SC22H21N3O3S2c11318(21(27)284)19(1665112916)2520(26)17(3022(25)2313)12147915(10814)24(2)3h51219H14H3b1712
methyl(2Z)2((4(dimethylamino)phenyl)methylidene)7methyl3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2Z)2((4DIMETHYLAMINOPHENYL)METHYLIDENE)7METHYL3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2Z)2(4(dimethylamino)benzylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL2(4(DIMETHYLAMINO)BENZYLIDENE)7METHYL3OXO5(2THIENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD01072498
ZINC000000627369
ZINC000000627371

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Available files

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