propyl 4-[[3-(2-ethoxyethoxy)phenyl]carbonylcarbamothioylamino]benzoate

Systemtic Name: propyl 4-[[3-(2-ethoxyethoxy)phenyl]carbonylcarbamothioylamino]benzoate Openeye Name: propyl 4-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]benzoate CAS Name: 4-[[[[[3-(2-ethoxyethoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]benzoate Traditional Name: 4-[[3-(2-ethoxyethoxy)benzoyl]thiocarbamoylamino]benzoic acid propyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCOCC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCOCC

InChI

InChI=1S/C22H26N2O5S/c1-3-12-29-21(26)16-8-10-18(11-9-16)23-22(30)24-20(25)17-6-5-7-19(15-17)28-14-13-27-4-2/h5-11,15H,3-4,12-14H2,1-2H3,(H2,23,24,25,30)