Vitas-M small molecule compound
ethyl (2Z)-7-methyl-2-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL405937
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1ccc(o1)N1CCOCC1)/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 C28H31N3O5S MW 521.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O5S/c1-5-35-27(33)24-18(4)29-28-31(25(24)20-8-6-19(7-9-20)17(2)3)26(32)22(37-28)16-21-10-11-23(36-21)30-12-14-34-15-13-30/h6-11,16-17,25H,5,12-15H2,1-4H3/b22-16-InChIKey
NTVHVLVURXNAOQ-JWGURIENSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)c(=Cc1ccc(o1)N1CCOCC1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)C)C(=O)C(=CC4=CC=C(O4)N5CCOCC5)S2)C
ethyl(2Z)7methyl2((5(morpholin4yl)furan2yl)methylidene)3oxo5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)7methyl2((5morpholin4ylfuran2yl)methylidene)3oxo5(4propan2ylphenyl)5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC28H31N3O5Sc153527(33)2418(4)292831(25(24)208619(7920)17(2)3)26(32)22(3728)1621101123(3621)30121434151330h611161725H51215H214H3b2216
MFCD30704389
ZINC000107803163
ZINC000107803167
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