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

Systemtic Name: 2-[methyl-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]amino]-N-phenethyl-benzamide Openeye Name: 2-[methyl-[[(E)-3-(2-thienyl)prop-2-enoyl]carbamothioyl]amino]-N-phenethyl-benzamide CAS Name: 2-[methyl-[[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[methyl-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]amino]-N-phenethylbenzamide Traditional Name: 2-[methyl-[[(E)-3-(2-thienyl)acryloyl]thiocarbamoyl]amino]-N-phenethyl-benzamide Formula: C24H23N3O2S2 MolecularWeight: 449.58832

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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=CS3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C(=S)NC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C24H23N3O2S2/c1-27(24(30)26-22(28)14-13-19-10-7-17-31-19)21-12-6-5-11-20(21)23(29)25-16-15-18-8-3-2-4-9-18/h2-14,17H,15-16H2,1H3,(H,25,29)(H,26,28,30)/b14-13+