Vitas-M small molecule compound
ethyl (2Z)-2-{[5-(4-methylpiperazin-1-yl)furan-2-yl]methylidene}-3-oxo-7-phenyl-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL436527
SMILES CCOC(=O)C1=C(N=c2n(C1c1cccs1)c(=O)/c(=C/c1ccc(o1)N1CCN(CC1)C)/s2)c1ccccc1
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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 C29H28N4O4S2 MW 560.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O4S2/c1-3-36-28(35)24-25(19-8-5-4-6-9-19)30-29-33(26(24)21-10-7-17-38-21)27(34)22(39-29)18-20-11-12-23(37-20)32-15-13-31(2)14-16-32/h4-12,17-18,26H,3,13-16H2,1-2H3/b22-18-InChIKey
LZNJSWFGALAMJO-PYCFMQQDSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1cccs1)c(=O)c(=Cc1ccc(o1)N1CCN(CC1)C)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CC=C(O4)N5CCN(CC5)C)S2)C6=CC=CC=C6
ethyl(2Z)2((5(4methylpiperazin1yl)furan2yl)methylidene)3oxo7phenyl5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((5(4METHYLPIPERAZIN1YL)FURAN2YL)METHYLIDENE)3OXO7PHENYL5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC29H28N4O4S2c133628(35)2425(198546919)302933(26(24)21107173821)27(34)22(3929)1820111223(3720)32151331(2)141632h412171826H31316H212H3b2218
MFCD30711983
ZINC000000685384
ZINC000000685386
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.