ethyl 1-[[4-(diethylamino)phenyl]carbamothioyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[[4-(diethylamino)phenyl]carbamothioyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[[4-(diethylamino)phenyl]carbamothioyl]piperidine-3-carboxylate CAS Name: 1-[[4-(diethylamino)anilino]-sulfanylidenemethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-(diethylamino)phenyl]carbamothioyl]piperidine-3-carboxylate Traditional Name: 1-[[4-(diethylamino)phenyl]thiocarbamoyl]nipecotic acid ethyl ester Formula: C19H29N3O2S MolecularWeight: 363.51746

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=S)N2CCCC(C2)C(=O)OCC

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=S)N2CCCC(C2)C(=O)OCC

InChI

InChI=1S/C19H29N3O2S/c1-4-21(5-2)17-11-9-16(10-12-17)20-19(25)22-13-7-8-15(14-22)18(23)24-6-3/h9-12,15H,4-8,13-14H2,1-3H3,(H,20,25)