5-[4-[2-(azepan-1-yl)ethoxy]phenyl]-2-(2-phenoxyethylsulfanylmethyl)-1,3-oxazole

Systemtic Name: 5-[4-[2-(azepan-1-yl)ethoxy]phenyl]-2-(2-phenoxyethylsulfanylmethyl)-1,3-oxazole Openeye Name: 5-[4-[2-(azepan-1-yl)ethoxy]phenyl]-2-(2-phenoxyethylsulfanylmethyl)oxazole CAS Name: 5-[4-[2-(1-azepanyl)ethoxy]phenyl]-2-[(2-phenoxyethylthio)methyl]oxazole IUPAC Name: 5-[4-[2-(azepan-1-yl)ethoxy]phenyl]-2-(2-phenoxyethylsulfanylmethyl)-1,3-oxazole Traditional Name: 5-[4-[2-(azepan-1-yl)ethoxy]phenyl]-2-[(2-phenoxyethylthio)methyl]oxazole Formula: C26H32N2O3S MolecularWeight: 452.60888

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOC2=CC=C(C=C2)C3=CN=C(O3)CSCCOC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CCOC2=CC=C(C=C2)C3=CN=C(O3)CSCCOC4=CC=CC=C4

InChI

InChI=1S/C26H32N2O3S/c1-2-7-15-28(14-6-1)16-17-29-24-12-10-22(11-13-24)25-20-27-26(31-25)21-32-19-18-30-23-8-4-3-5-9-23/h3-5,8-13,20H,1-2,6-7,14-19,21H2