(E)-N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[[3-[(1-oxo-2-phenylethyl)amino]anilino]-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[[3-[(2-phenylacetyl)amino]phenyl]thiocarbamoyl]-3-(2-thienyl)acrylamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C=CC3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C22H19N3O2S2/c26-20(12-11-19-10-5-13-29-19)25-22(28)24-18-9-4-8-17(15-18)23-21(27)14-16-6-2-1-3-7-16/h1-13,15H,14H2,(H,23,27)(H2,24,25,26,28)/b12-11+