N-methyl-N-(phenylmethyl)-3-(3-phenylpropanoylcarbamothioylamino)benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O2S/c1-28(18-20-11-6-3-7-12-20)24(30)21-13-8-14-22(17-21)26-25(31)27-23(29)16-15-19-9-4-2-5-10-19/h2-14,17H,15-16,18H2,1H3,(H2,26,27,29,31)