3-(2-phenylethanoylcarbamothioylamino)-N-(phenylmethyl)benzamide

Systemtic Name: 3-(2-phenylethanoylcarbamothioylamino)-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-[(2-phenylacetyl)carbamothioylamino]benzamide CAS Name: 3-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-[(2-phenylacetyl)carbamothioylamino]benzamide Traditional Name: N-benzyl-3-[(2-phenylacetyl)thiocarbamoylamino]benzamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O2S/c27-21(14-17-8-3-1-4-9-17)26-23(29)25-20-13-7-12-19(15-20)22(28)24-16-18-10-5-2-6-11-18/h1-13,15H,14,16H2,(H,24,28)(H2,25,26,27,29)