propyl 4-[(4-pentoxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: propyl 4-[(4-pentoxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: propyl 4-[(4-pentoxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[oxo-(4-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(4-pentoxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-amoxybenzoyl)thiocarbamoylamino]benzoic acid propyl ester Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OCCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OCCC

InChI

InChI=1S/C23H28N2O4S/c1-3-5-6-16-28-20-13-9-17(10-14-20)21(26)25-23(30)24-19-11-7-18(8-12-19)22(27)29-15-4-2/h7-14H,3-6,15-16H2,1-2H3,(H2,24,25,26,30)