3-methoxy-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4-phenylmethoxy-benzenecarbothioamide

Systemtic Name: 3-methoxy-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4-phenylmethoxy-benzenecarbothioamide Openeye Name: 4-benzyloxy-3-methoxy-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzenecarbothioamide CAS Name: 3-methoxy-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-4-phenylmethoxybenzenecarbothioamide IUPAC Name: 3-methoxy-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4-phenylmethoxybenzenecarbothioamide Traditional Name: 4-benzoxy-N-[3-(2-ketopyrrolidino)propyl]-3-methoxy-thiobenzamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=S)NCCCN2CCCC2=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=S)NCCCN2CCCC2=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3S/c1-26-20-15-18(10-11-19(20)27-16-17-7-3-2-4-8-17)22(28)23-12-6-14-24-13-5-9-21(24)25/h2-4,7-8,10-11,15H,5-6,9,12-14,16H2,1H3,(H,23,28)