ethyl 2-[[4-(diethylamino)phenyl]carbamothioylamino]hexanoate

Systemtic Name: ethyl 2-[[4-(diethylamino)phenyl]carbamothioylamino]hexanoate Openeye Name: ethyl 2-[[4-(diethylamino)phenyl]carbamothioylamino]hexanoate CAS Name: 2-[[[4-(diethylamino)anilino]-sulfanylidenemethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-(diethylamino)phenyl]carbamothioylamino]hexanoate Traditional Name: 2-[[4-(diethylamino)phenyl]thiocarbamoylamino]hexanoic acid ethyl ester Formula: C19H31N3O2S MolecularWeight: 365.53334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)NC(=S)NC1=CC=C(C=C1)N(CC)CC

Isomeric SMILES

CCCCC(C(=O)OCC)NC(=S)NC1=CC=C(C=C1)N(CC)CC

InChI

InChI=1S/C19H31N3O2S/c1-5-9-10-17(18(23)24-8-4)21-19(25)20-15-11-13-16(14-12-15)22(6-2)7-3/h11-14,17H,5-10H2,1-4H3,(H2,20,21,25)