N-ethyl-5-[(2-methylsulfanylphenoxy)methyl]-N-(2-pyrrolidin-1-ylethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-ethyl-5-[(2-methylsulfanylphenoxy)methyl]-N-(2-pyrrolidin-1-ylethyl)-1,2-oxazole-3-carboxamide Openeye Name: N-ethyl-5-[(2-methylsulfanylphenoxy)methyl]-N-(2-pyrrolidin-1-ylethyl)isoxazole-3-carboxamide CAS Name: N-ethyl-5-[[2-(methylthio)phenoxy]methyl]-N-[2-(1-pyrrolidinyl)ethyl]-3-isoxazolecarboxamide IUPAC Name: N-ethyl-5-[(2-methylsulfanylphenoxy)methyl]-N-(2-pyrrolidin-1-ylethyl)-1,2-oxazole-3-carboxamide Traditional Name: N-ethyl-5-[[2-(methylthio)phenoxy]methyl]-N-(2-pyrrolidinoethyl)isoxazole-3-carboxamide Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCN1CCCC1)C(=O)C2=NOC(=C2)COC3=CC=CC=C3SC

Isomeric SMILES

CCN(CCN1CCCC1)C(=O)C2=NOC(=C2)COC3=CC=CC=C3SC

InChI

InChI=1S/C20H27N3O3S/c1-3-23(13-12-22-10-6-7-11-22)20(24)17-14-16(26-21-17)15-25-18-8-4-5-9-19(18)27-2/h4-5,8-9,14H,3,6-7,10-13,15H2,1-2H3