3-[(phenylmethyl)-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]amino]propanamide

Systemtic Name: 3-[(phenylmethyl)-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]amino]propanamide Openeye Name: 3-[benzyl-[[(E)-3-(2-thienyl)prop-2-enoyl]carbamothioyl]amino]propanamide CAS Name: 3-[[[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-sulfanylidenemethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]amino]propanamide Traditional Name: 3-[benzyl-[[(E)-3-(2-thienyl)acryloyl]thiocarbamoyl]amino]propionamide Formula: C18H19N3O2S2 MolecularWeight: 373.49236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O2S2/c19-16(22)10-11-21(13-14-5-2-1-3-6-14)18(24)20-17(23)9-8-15-7-4-12-25-15/h1-9,12H,10-11,13H2,(H2,19,22)(H,20,23,24)/b9-8+