N#Cc1c(Cl)nc(SCc2coc(-c3ccc(Cl)cc3)n2)c(C#N)c1-c1ccc(OC[C@@H](O)CO)cc1

名称: compound

IUPAC: 2-chloro-6-[[2-(4-chlorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]-4-[4-[(2S)-2,3-dihydroxypropoxy]phenyl]pyridine-3,5-dicarbonitrile

SMILES: N#Cc1c(Cl)nc(SCc2coc(-c3ccc(Cl)cc3)n2)c(C#N)c1-c1ccc(OC[C@@H](O)CO)cc1

Canonical SMILES: C1=CC(=CC=C1C2=C(C(=NC(=C2C#N)Cl)SCC3=COC(=N3)C4=CC=C(C=C4)Cl)C#N)OCC(CO)O

分子式: C26H18Cl2N4O4S

分子量: 553.40

InChIKey: GUWLSSBLQIFMIW-IBGZPJMESA-N

InChI:

InChI=1S/C26H18Cl2N4O4S/c27-17-5-1-16(2-6-17)25-31-18(12-36-25)14-37-26-22(10-30)23(21(9-29)24(28)32-26)15-3-7-20(8-4-15)35-13-19(34)11-33/h1-8,12,19,33-34H,11,13-14H2/t19-/m0/s1

PubChem CID: 86649640 →

同義語

SCHEMBL950541GUWLSSBLQIFMIW-IBGZPJMESA-N2-Chloro-6-({[2-(4-chlorophenyl)-1,3-oxazol-4-yl]methyl}thio)-4-(4-{[(2S)-2,3-dihydroxypropyl]-oxy}phenyl)pyridine-3,5-dicarbonitrile2-Chloro-6-({[2-(4-chlorophenyl)-1,3-oxazol-4-yl]methyl}thio)-4-(4-{[(2S)-2,3-dihydroxypropyl]oxy}phenyl)pyridine-3,5-dicarbonitrile

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