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

Systemtic Name: 2-[methyl-[[(E)-3-phenylprop-2-enoyl]carbamothioyl]amino]-N-phenethyl-benzamide Openeye Name: 2-[methyl-[[(E)-3-phenylprop-2-enoyl]carbamothioyl]amino]-N-phenethyl-benzamide CAS Name: 2-[methyl-[[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[methyl-[[(E)-3-phenylprop-2-enoyl]carbamothioyl]amino]-N-phenethylbenzamide Traditional Name: 2-[methyl-[[(E)-3-phenylacryloyl]thiocarbamoyl]amino]-N-phenethyl-benzamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C(=S)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C(=S)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C26H25N3O2S/c1-29(26(32)28-24(30)17-16-20-10-4-2-5-11-20)23-15-9-8-14-22(23)25(31)27-19-18-21-12-6-3-7-13-21/h2-17H,18-19H2,1H3,(H,27,31)(H,28,30,32)/b17-16+