propyl 4-oxidanylidene-4-[[2-(3-phenylpropoxy)phenyl]carbamothioylamino]butanoate

Systemtic Name: propyl 4-oxidanylidene-4-[[2-(3-phenylpropoxy)phenyl]carbamothioylamino]butanoate Openeye Name: propyl 4-oxo-4-[[2-(3-phenylpropoxy)phenyl]carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[[2-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]amino]butanoic acid propyl ester IUPAC Name: propyl 4-oxo-4-[[2-(3-phenylpropoxy)phenyl]carbamothioylamino]butanoate Traditional Name: 4-keto-4-[[2-(3-phenylpropoxy)phenyl]thiocarbamoylamino]butyric acid propyl ester Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1OCCCC2=CC=CC=C2

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1OCCCC2=CC=CC=C2

InChI

InChI=1S/C23H28N2O4S/c1-2-16-29-22(27)15-14-21(26)25-23(30)24-19-12-6-7-13-20(19)28-17-8-11-18-9-4-3-5-10-18/h3-7,9-10,12-13H,2,8,11,14-17H2,1H3,(H2,24,25,26,30)