3-(3-phenylpropanoylcarbamothioylamino)-N,N-dipropyl-benzamide

Systemtic Name: 3-(3-phenylpropanoylcarbamothioylamino)-N,N-dipropyl-benzamide Openeye Name: 3-(3-phenylpropanoylcarbamothioylamino)-N,N-dipropyl-benzamide CAS Name: 3-[[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]amino]-N,N-dipropylbenzamide IUPAC Name: 3-(3-phenylpropanoylcarbamothioylamino)-N,N-dipropylbenzamide Traditional Name: 3-(hydrocinnamoylthiocarbamoylamino)-N,N-dipropyl-benzamide Formula: C23H29N3O2S MolecularWeight: 411.56026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC=C1)NC(=S)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC=C1)NC(=S)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C23H29N3O2S/c1-3-15-26(16-4-2)22(28)19-11-8-12-20(17-19)24-23(29)25-21(27)14-13-18-9-6-5-7-10-18/h5-12,17H,3-4,13-16H2,1-2H3,(H2,24,25,27,29)