N-(1-phenylethyl)-4-(propanoylcarbamothioylamino)benzamide

Systemtic Name: N-(1-phenylethyl)-4-(propanoylcarbamothioylamino)benzamide Openeye Name: N-(1-phenylethyl)-4-(propanoylcarbamothioylamino)benzamide CAS Name: 4-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: N-(1-phenylethyl)-4-(propanoylcarbamothioylamino)benzamide Traditional Name: N-(1-phenylethyl)-4-(propionylthiocarbamoylamino)benzamide Formula: C19H21N3O2S MolecularWeight: 355.45394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NC(C)C2=CC=CC=C2

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NC(C)C2=CC=CC=C2

InChI

InChI=1S/C19H21N3O2S/c1-3-17(23)22-19(25)21-16-11-9-15(10-12-16)18(24)20-13(2)14-7-5-4-6-8-14/h4-13H,3H2,1-2H3,(H,20,24)(H2,21,22,23,25)