2-[methyl-[[(E)-3-phenylprop-2-enoyl]carbamothioyl]amino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[methyl-[[(E)-3-phenylprop-2-enoyl]carbamothioyl]amino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[methyl-[[(E)-3-phenylprop-2-enoyl]carbamothioyl]amino]benzamide CAS Name: 2-[methyl-[[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[methyl-[[(E)-3-phenylprop-2-enoyl]carbamothioyl]amino]benzamide Traditional Name: N-benzyl-2-[methyl-[[(E)-3-phenylacryloyl]thiocarbamoyl]amino]benzamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=S)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=S)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H23N3O2S/c1-28(25(31)27-23(29)17-16-19-10-4-2-5-11-19)22-15-9-8-14-21(22)24(30)26-18-20-12-6-3-7-13-20/h2-17H,18H2,1H3,(H,26,30)(H,27,29,31)/b17-16+