2-(3,5-dimethylphenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]acetamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[[2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]acetamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-[(2-pyrrolidinophenyl)thiocarbamoyl]acetamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC(=S)NC2=CC=CC=C2N3CCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC(=S)NC2=CC=CC=C2N3CCCC3)C

InChI

InChI=1S/C21H25N3O2S/c1-15-11-16(2)13-17(12-15)26-14-20(25)23-21(27)22-18-7-3-4-8-19(18)24-9-5-6-10-24/h3-4,7-8,11-13H,5-6,9-10,14H2,1-2H3,(H2,22,23,25,27)