methyl 4-[[2,2-diethoxyethyl(phenethyl)carbamothioyl]amino]benzoate

Systemtic Name: methyl 4-[[2,2-diethoxyethyl(phenethyl)carbamothioyl]amino]benzoate Openeye Name: methyl 4-[[2,2-diethoxyethyl(phenethyl)carbamothioyl]amino]benzoate CAS Name: 4-[[[2,2-diethoxyethyl(phenethyl)amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2,2-diethoxyethyl(phenethyl)carbamothioyl]amino]benzoate Traditional Name: 4-[[2,2-diethoxyethyl(phenethyl)thiocarbamoyl]amino]benzoic acid methyl ester Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN(CCC1=CC=CC=C1)C(=S)NC2=CC=C(C=C2)C(=O)OC)OCC

Isomeric SMILES

CCOC(CN(CCC1=CC=CC=C1)C(=S)NC2=CC=C(C=C2)C(=O)OC)OCC

InChI

InChI=1S/C23H30N2O4S/c1-4-28-21(29-5-2)17-25(16-15-18-9-7-6-8-10-18)23(30)24-20-13-11-19(12-14-20)22(26)27-3/h6-14,21H,4-5,15-17H2,1-3H3,(H,24,30)