[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone

Systemtic Name: [2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone Openeye Name: [2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone CAS Name: [2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-[4-[(methylthio)methyl]phenyl]methanone IUPAC Name: [2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone Traditional Name: [2-(2,4-dimethoxyphenyl)pyrrolidino]-[4-[(methylthio)methyl]phenyl]methanone Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCCN2C(=O)C3=CC=C(C=C3)CSC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2CCCN2C(=O)C3=CC=C(C=C3)CSC)OC

InChI

InChI=1S/C21H25NO3S/c1-24-17-10-11-18(20(13-17)25-2)19-5-4-12-22(19)21(23)16-8-6-15(7-9-16)14-26-3/h6-11,13,19H,4-5,12,14H2,1-3H3