2-(pentanoylcarbamothioylamino)-N-phenyl-benzamide

Systemtic Name: 2-(pentanoylcarbamothioylamino)-N-phenyl-benzamide Openeye Name: 2-(pentanoylcarbamothioylamino)-N-phenyl-benzamide CAS Name: 2-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: 2-(pentanoylcarbamothioylamino)-N-phenylbenzamide Traditional Name: N-phenyl-2-(valerylthiocarbamoylamino)benzamide Formula: C19H21N3O2S MolecularWeight: 355.45394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NC2=CC=CC=C2

InChI

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