N,N-dimethyl-3-[4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]phenyl]propanamide

Systemtic Name: N,N-dimethyl-3-[4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]phenyl]propanamide Openeye Name: N,N-dimethyl-3-[4-[[(E)-3-(2-thienyl)prop-2-enoyl]carbamothioylamino]phenyl]propanamide CAS Name: N,N-dimethyl-3-[4-[[[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: N,N-dimethyl-3-[4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]phenyl]propanamide Traditional Name: N,N-dimethyl-3-[4-[[(E)-3-(2-thienyl)acryloyl]thiocarbamoylamino]phenyl]propionamide Formula: C19H21N3O2S2 MolecularWeight: 387.51894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC=CS2

Isomeric SMILES

CN(C)C(=O)CCC1=CC=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C19H21N3O2S2/c1-22(2)18(24)12-7-14-5-8-15(9-6-14)20-19(25)21-17(23)11-10-16-4-3-13-26-16/h3-6,8-11,13H,7,12H2,1-2H3,(H2,20,21,23,25)/b11-10+