2-(2,4-dimethylphenyl)sulfanyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)ethanamide

Systemtic Name: 2-(2,4-dimethylphenyl)sulfanyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)ethanamide Openeye Name: 2-(2,4-dimethylphenyl)sulfanyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)acetamide CAS Name: 2-[(2,4-dimethylphenyl)thio]-N-[2-methyl-4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(2,4-dimethylphenyl)sulfanyl-N-(2-methyl-4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[(2,4-dimethylphenyl)thio]-N-(2-methyl-4-pyrrolidino-phenyl)acetamide Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)N3CCCC3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)N3CCCC3)C)C

InChI

InChI=1S/C21H26N2OS/c1-15-6-9-20(17(3)12-15)25-14-21(24)22-19-8-7-18(13-16(19)2)23-10-4-5-11-23/h6-9,12-13H,4-5,10-11,14H2,1-3H3,(H,22,24)