2-(2-methoxy-4-pyrrolidin-1-ylcarbothioyl-phenoxy)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(2-methoxy-4-pyrrolidin-1-ylcarbothioyl-phenoxy)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[2-methoxy-4-(pyrrolidine-1-carbothioyl)phenoxy]acetamide CAS Name: 2-[2-methoxy-4-[1-pyrrolidinyl(sulfanylidene)methyl]phenoxy]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[2-methoxy-4-(pyrrolidine-1-carbothioyl)phenoxy]acetamide Traditional Name: N-benzyl-2-[2-methoxy-4-(pyrrolidine-1-carbothioyl)phenoxy]acetamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=S)N2CCCC2)OCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=S)N2CCCC2)OCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3S/c1-25-19-13-17(21(27)23-11-5-6-12-23)9-10-18(19)26-15-20(24)22-14-16-7-3-2-4-8-16/h2-4,7-10,13H,5-6,11-12,14-15H2,1H3,(H,22,24)