ethyl 4-[(1,2,2,4-tetramethylquinolin-6-yl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(1,2,2,4-tetramethylquinolin-6-yl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(1,2,2,4-tetramethyl-6-quinolyl)carbamothioylamino]benzoate CAS Name: 4-[[sulfanylidene-[(1,2,2,4-tetramethyl-6-quinolinyl)amino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1,2,2,4-tetramethylquinolin-6-yl)carbamothioylamino]benzoate Traditional Name: 4-[(1,2,2,4-tetramethyl-6-quinolyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC3=C(C=C2)N(C(C=C3C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC3=C(C=C2)N(C(C=C3C)(C)C)C

InChI

InChI=1S/C23H27N3O2S/c1-6-28-21(27)16-7-9-17(10-8-16)24-22(29)25-18-11-12-20-19(13-18)15(2)14-23(3,4)26(20)5/h7-14H,6H2,1-5H3,(H2,24,25,29)