3-(3-phenylpropanoylcarbamothioylamino)-N-propan-2-yl-benzamide

Systemtic Name: 3-(3-phenylpropanoylcarbamothioylamino)-N-propan-2-yl-benzamide Openeye Name: N-isopropyl-3-(3-phenylpropanoylcarbamothioylamino)benzamide CAS Name: 3-[[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 3-(3-phenylpropanoylcarbamothioylamino)-N-propan-2-ylbenzamide Traditional Name: 3-(hydrocinnamoylthiocarbamoylamino)-N-isopropyl-benzamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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