propyl 4-oxidanylidene-4-[(3-phenethyloxyphenyl)carbamothioylamino]butanoate

Systemtic Name: propyl 4-oxidanylidene-4-[(3-phenethyloxyphenyl)carbamothioylamino]butanoate Openeye Name: propyl 4-oxo-4-[(3-phenethyloxyphenyl)carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[(3-phenethyloxyanilino)-sulfanylidenemethyl]amino]butanoic acid propyl ester IUPAC Name: propyl 4-oxo-4-[(3-phenethyloxyphenyl)carbamothioylamino]butanoate Traditional Name: 4-keto-4-[(3-phenethyloxyphenyl)thiocarbamoylamino]butyric acid propyl ester Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NC1=CC(=CC=C1)OCCC2=CC=CC=C2

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NC1=CC(=CC=C1)OCCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O4S/c1-2-14-28-21(26)12-11-20(25)24-22(29)23-18-9-6-10-19(16-18)27-15-13-17-7-4-3-5-8-17/h3-10,16H,2,11-15H2,1H3,(H2,23,24,25,29)