propyl 3-(3-phenylpropanoylcarbamothioylamino)benzoate

Systemtic Name: propyl 3-(3-phenylpropanoylcarbamothioylamino)benzoate Openeye Name: propyl 3-(3-phenylpropanoylcarbamothioylamino)benzoate CAS Name: 3-[[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 3-(3-phenylpropanoylcarbamothioylamino)benzoate Traditional Name: 3-(hydrocinnamoylthiocarbamoylamino)benzoic acid propyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O3S/c1-2-13-25-19(24)16-9-6-10-17(14-16)21-20(26)22-18(23)12-11-15-7-4-3-5-8-15/h3-10,14H,2,11-13H2,1H3,(H2,21,22,23,26)