ethyl 3-(2-dimethylaminoethylcarbamothioylamino)benzoate

Systemtic Name: ethyl 3-(2-dimethylaminoethylcarbamothioylamino)benzoate Openeye Name: ethyl 3-(2-dimethylaminoethylcarbamothioylamino)benzoate CAS Name: 3-[[(2-dimethylaminoethylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(2-dimethylaminoethylcarbamothioylamino)benzoate Traditional Name: 3-(2-dimethylaminoethylthiocarbamoylamino)benzoic acid ethyl ester Formula: C14H21N3O2S MolecularWeight: 295.40044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=S)NCCN(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=S)NCCN(C)C

InChI

InChI=1S/C14H21N3O2S/c1-4-19-13(18)11-6-5-7-12(10-11)16-14(20)15-8-9-17(2)3/h5-7,10H,4,8-9H2,1-3H3,(H2,15,16,20)