N-[(3-phenylpropanoylamino)carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[(3-phenylpropanoylamino)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[(3-phenylpropanoylamino)carbamothioyl]benzamide CAS Name: N-[[(1-oxo-3-phenylpropyl)hydrazo]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[(3-phenylpropanoylamino)carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[(hydrocinnamoylamino)thiocarbamoyl]-4-isopropyl-benzamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C20H23N3O2S/c1-14(2)16-9-11-17(12-10-16)19(25)21-20(26)23-22-18(24)13-8-15-6-4-3-5-7-15/h3-7,9-12,14H,8,13H2,1-2H3,(H,22,24)(H2,21,23,25,26)