N-[(2-phenylethanoylamino)carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[(2-phenylethanoylamino)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[[(2-phenylacetyl)amino]carbamothioyl]benzamide CAS Name: N-[[(1-oxo-2-phenylethyl)hydrazo]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[(2-phenylacetyl)amino]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[[(2-phenylacetyl)amino]thiocarbamoyl]benzamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H21N3O2S/c1-13(2)15-8-10-16(11-9-15)18(24)20-19(25)22-21-17(23)12-14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3,(H,21,23)(H2,20,22,24,25)