N-ethyl-N-phenyl-3-(3-phenylpropanoylcarbamothioylamino)benzamide

Systemtic Name: N-ethyl-N-phenyl-3-(3-phenylpropanoylcarbamothioylamino)benzamide Openeye Name: N-ethyl-N-phenyl-3-(3-phenylpropanoylcarbamothioylamino)benzamide CAS Name: N-ethyl-3-[[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-ethyl-N-phenyl-3-(3-phenylpropanoylcarbamothioylamino)benzamide Traditional Name: N-ethyl-3-(hydrocinnamoylthiocarbamoylamino)-N-phenyl-benzamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O2S/c1-2-28(22-14-7-4-8-15-22)24(30)20-12-9-13-21(18-20)26-25(31)27-23(29)17-16-19-10-5-3-6-11-19/h3-15,18H,2,16-17H2,1H3,(H2,26,27,29,31)