N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[(3-isopentyloxyphenyl)carbamothioyl]-3-phenyl-propanamide CAS Name: N-[[3-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenylpropanamide Traditional Name: N-[(3-isoamoxyphenyl)thiocarbamoyl]-3-phenyl-propionamide Formula: C21H26N2O2S MolecularWeight: 370.50834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O2S/c1-16(2)13-14-25-19-10-6-9-18(15-19)22-21(26)23-20(24)12-11-17-7-4-3-5-8-17/h3-10,15-16H,11-14H2,1-2H3,(H2,22,23,24,26)