N-(4-ethoxyphenyl)-2-(3-phenylpropanoylcarbamothioylamino)benzamide

Systemtic Name: N-(4-ethoxyphenyl)-2-(3-phenylpropanoylcarbamothioylamino)benzamide Openeye Name: N-(4-ethoxyphenyl)-2-(3-phenylpropanoylcarbamothioylamino)benzamide CAS Name: N-(4-ethoxyphenyl)-2-[[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(4-ethoxyphenyl)-2-(3-phenylpropanoylcarbamothioylamino)benzamide Traditional Name: 2-(hydrocinnamoylthiocarbamoylamino)-N-p-phenetyl-benzamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O3S/c1-2-31-20-15-13-19(14-16-20)26-24(30)21-10-6-7-11-22(21)27-25(32)28-23(29)17-12-18-8-4-3-5-9-18/h3-11,13-16H,2,12,17H2,1H3,(H,26,30)(H2,27,28,29,32)