S-phenyl N-[3-(propanoylamino)phenyl]carbamothioate

Systemtic Name: S-phenyl N-[3-(propanoylamino)phenyl]carbamothioate Openeye Name: S-phenyl N-[3-(propanoylamino)phenyl]carbamothioate CAS Name: N-[3-(1-oxopropylamino)phenyl]carbamothioic acid S-phenyl ester IUPAC Name: S-phenyl N-[3-(propanoylamino)phenyl]carbamothioate Traditional Name: N-(3-propionamidophenyl)thiocarbamic acid S-phenyl ester Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=O)SC2=CC=CC=C2

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=O)SC2=CC=CC=C2

InChI

InChI=1S/C16H16N2O2S/c1-2-15(19)17-12-7-6-8-13(11-12)18-16(20)21-14-9-4-3-5-10-14/h3-11H,2H2,1H3,(H,17,19)(H,18,20)