ethyl 4-[(4-dimethylaminophenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(4-dimethylaminophenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-dimethylaminophenyl)carbamothioylamino]benzoate CAS Name: 4-[[[4-(dimethylamino)anilino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-dimethylaminophenyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-dimethylaminophenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O2S/c1-4-23-17(22)13-5-7-14(8-6-13)19-18(24)20-15-9-11-16(12-10-15)21(2)3/h5-12H,4H2,1-3H3,(H2,19,20,24)