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

Systemtic Name: 5-[4-[3-(azepan-1-yl)propoxy]phenyl]-2-(2-phenoxyethylsulfanylmethyl)-1,3-oxazole Openeye Name: 5-[4-[3-(azepan-1-yl)propoxy]phenyl]-2-(2-phenoxyethylsulfanylmethyl)oxazole CAS Name: 5-[4-[3-(1-azepanyl)propoxy]phenyl]-2-[(2-phenoxyethylthio)methyl]oxazole IUPAC Name: 5-[4-[3-(azepan-1-yl)propoxy]phenyl]-2-(2-phenoxyethylsulfanylmethyl)-1,3-oxazole Traditional Name: 5-[4-[3-(azepan-1-yl)propoxy]phenyl]-2-[(2-phenoxyethylthio)methyl]oxazole Formula: C27H34N2O3S MolecularWeight: 466.63546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCOC2=CC=C(C=C2)C3=CN=C(O3)CSCCOC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CCCOC2=CC=C(C=C2)C3=CN=C(O3)CSCCOC4=CC=CC=C4

InChI

InChI=1S/C27H34N2O3S/c1-2-7-16-29(15-6-1)17-8-18-30-25-13-11-23(12-14-25)26-21-28-27(32-26)22-33-20-19-31-24-9-4-3-5-10-24/h3-5,9-14,21H,1-2,6-8,15-20,22H2