5-(2-phenoxyethylsulfanylmethyl)-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2-oxazole

Systemtic Name: 5-(2-phenoxyethylsulfanylmethyl)-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2-oxazole Openeye Name: 5-(2-phenoxyethylsulfanylmethyl)-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]isoxazole CAS Name: 5-[(2-phenoxyethylthio)methyl]-3-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]isoxazole IUPAC Name: 5-(2-phenoxyethylsulfanylmethyl)-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2-oxazole Traditional Name: 5-[(2-phenoxyethylthio)methyl]-3-[4-(2-pyrrolidinoethoxy)phenyl]isoxazole Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)C3=NOC(=C3)CSCCOC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)C3=NOC(=C3)CSCCOC4=CC=CC=C4

InChI

InChI=1S/C24H28N2O3S/c1-2-6-21(7-3-1)28-16-17-30-19-23-18-24(25-29-23)20-8-10-22(11-9-20)27-15-14-26-12-4-5-13-26/h1-3,6-11,18H,4-5,12-17,19H2