N-[1-(1-benzofuran-2-ylmethyl)pyrrolidin-3-yl]-N-methyl-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-[1-(1-benzofuran-2-ylmethyl)pyrrolidin-3-yl]-N-methyl-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-[1-(benzofuran-2-ylmethyl)pyrrolidin-3-yl]-N-methyl-4-(4-methylsulfanylphenyl)-4-oxo-butanamide CAS Name: N-[1-(2-benzofuranylmethyl)-3-pyrrolidinyl]-N-methyl-4-[4-(methylthio)phenyl]-4-oxobutanamide IUPAC Name: N-[1-(1-benzofuran-2-ylmethyl)pyrrolidin-3-yl]-N-methyl-4-(4-methylsulfanylphenyl)-4-oxobutanamide Traditional Name: N-[1-(benzofuran-2-ylmethyl)pyrrolidin-3-yl]-4-keto-N-methyl-4-[4-(methylthio)phenyl]butyramide Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(C1)CC2=CC3=CC=CC=C3O2)C(=O)CCC(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

CN(C1CCN(C1)CC2=CC3=CC=CC=C3O2)C(=O)CCC(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C25H28N2O3S/c1-26(25(29)12-11-23(28)18-7-9-22(31-2)10-8-18)20-13-14-27(16-20)17-21-15-19-5-3-4-6-24(19)30-21/h3-10,15,20H,11-14,16-17H2,1-2H3