4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzamide

Systemtic Name: 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzamide Openeye Name: 4-[[(E)-3-(2-thienyl)prop-2-enoyl]carbamothioylamino]benzamide CAS Name: 4-[[[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzamide Traditional Name: 4-[[(E)-3-(2-thienyl)acryloyl]thiocarbamoylamino]benzamide Formula: C15H13N3O2S2 MolecularWeight: 331.41262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

C1=CSC(=C1)/C=C/C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C15H13N3O2S2/c16-14(20)10-3-5-11(6-4-10)17-15(21)18-13(19)8-7-12-2-1-9-22-12/h1-9H,(H2,16,20)(H2,17,18,19,21)/b8-7+