Vitas-M small molecule compound
ethyl (2Z)-2-[(1-benzyl-1H-indol-3-yl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK698407
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1cn(c3c1cccc3)Cc1ccccc1)/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 C30H25N3O3S2 MW 539.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N3O3S2/c1-3-36-29(35)26-19(2)31-30-33(27(26)24-14-9-15-37-24)28(34)25(38-30)16-21-18-32(17-20-10-5-4-6-11-20)23-13-8-7-12-22(21)23/h4-16,18,27H,3,17H2,1-2H3/b25-16-InChIKey
YNBKDJGZCSLKIW-XYGWBWBKSA-NSynonyms
(Z)ethyl2((1benzyl1Hindol3yl)methylene)7methyl3oxo5(thiophen2yl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1cn(c3c1cccc3)Cc1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CN(C5=CC=CC=C54)CC6=CC=CC=C6)S2)C
ethyl(2Z)2((1benzyl1Hindol3yl)methylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((1BENZYLINDOL3YL)METHYLIDENE)7METHYL3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H25N3O3S2c133629(35)2619(2)313033(27(26)24149153724)28(34)25(3830)16211832(1720105461120)2313871222(21)23h4161827H317H212H3b2516
MFCD02064420
ZINC000002365090
ZINC000002365094
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