ethyl 4-[3-(diethylamino)propylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[3-(diethylamino)propylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[3-(diethylamino)propylcarbamothioylamino]benzoate CAS Name: 4-[[[3-(diethylamino)propylamino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(diethylamino)propylcarbamothioylamino]benzoate Traditional Name: 4-[3-(diethylamino)propylthiocarbamoylamino]benzoic acid ethyl ester Formula: C17H27N3O2S MolecularWeight: 337.48018

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=S)NC1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCN(CC)CCCNC(=S)NC1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C17H27N3O2S/c1-4-20(5-2)13-7-12-18-17(23)19-15-10-8-14(9-11-15)16(21)22-6-3/h8-11H,4-7,12-13H2,1-3H3,(H2,18,19,23)