2-(4-tert-butylphenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[(2-pyrrolidinophenyl)thiocarbamoyl]acetamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O2S/c1-23(2,3)17-10-12-18(13-11-17)28-16-21(27)25-22(29)24-19-8-4-5-9-20(19)26-14-6-7-15-26/h4-5,8-13H,6-7,14-16H2,1-3H3,(H2,24,25,27,29)