Vitas-M small molecule compound
ethyl (2Z)-2-[4-(benzyloxy)-3-iodo-5-methoxybenzylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK325752
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1cc(I)c(c(c1)OC)OCc1ccccc1)/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 C31H27IN2O5S MW 666.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27IN2O5S/c1-4-38-30(36)26-19(2)33-31-34(27(26)22-13-9-6-10-14-22)29(35)25(40-31)17-21-15-23(32)28(24(16-21)37-3)39-18-20-11-7-5-8-12-20/h5-17,27H,4,18H2,1-3H3/b25-17-InChIKey
JMQYJQKVMQVBRJ-UQQQWYQISA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1cc(I)c(c(c1)OC)OCc1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC(=C(C(=C4)I)OCC5=CC=CC=C5)OC)S2)C
ETHYL(2Z)2((3IODO5METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(4(BENZYLOXY)3IODO5METHOXYBENZYLIDENE)7METHYL3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H27IN2O5Sc143830(36)2619(2)333134(27(26)221396101422)29(35)25(4031)17211523(32)28(24(1621)373)391820117581220h51727H418H213H3b2517
MFCD02109426
ZINC000150439511
ZINC000150439516
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Check stock on Vitas-MAvailable files
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