Vitas-M small molecule compound
ethyl (2Z)-2-{[5-(4-methylpiperazin-1-yl)furan-2-yl]methylidene}-3-oxo-5,7-diphenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL436529
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccccc1)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 C31H30N4O4S MW 554.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O4S/c1-3-38-30(37)26-27(21-10-6-4-7-11-21)32-31-35(28(26)22-12-8-5-9-13-22)29(36)24(40-31)20-23-14-15-25(39-23)34-18-16-33(2)17-19-34/h4-15,20,28H,3,16-19H2,1-2H3/b24-20-InChIKey
SFACYNHERXFXKP-GFMRDNFCSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc(o1)N1CCN(CC1)C)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC=C(O4)N5CCN(CC5)C)S2)C6=CC=CC=C6
ethyl(2Z)2((5(4methylpiperazin1yl)furan2yl)methylidene)3oxo57diphenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((5(4METHYLPIPERAZIN1YL)FURAN2YL)METHYLIDENE)3OXO57DIPHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H30N4O4Sc133830(37)2627(21106471121)323135(28(26)22128591322)29(36)24(4031)2023141525(3923)34181633(2)171934h4152028H31619H212H3b2420
MFCD30711985
ZINC000101381531
ZINC000101381533
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