2-(3,4-dimethoxyphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-[(3,4-dimethoxyphenyl)thio]-N-(4-pyrrolidinobenzyl)acetamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)NCC2=CC=C(C=C2)N3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)NCC2=CC=C(C=C2)N3CCCC3)OC

InChI

InChI=1S/C21H26N2O3S/c1-25-19-10-9-18(13-20(19)26-2)27-15-21(24)22-14-16-5-7-17(8-6-16)23-11-3-4-12-23/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,22,24)