ethyl 4-[(2,6-diethylphenyl)carbamothioylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(2,6-diethylphenyl)carbamothioylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(2,6-diethylphenyl)carbamothioylamino]piperidine-1-carboxylate CAS Name: 4-[[(2,6-diethylanilino)-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2,6-diethylphenyl)carbamothioylamino]piperidine-1-carboxylate Traditional Name: 4-[(2,6-diethylphenyl)thiocarbamoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C19H29N3O2S MolecularWeight: 363.51746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2CCN(CC2)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C19H29N3O2S/c1-4-14-8-7-9-15(5-2)17(14)21-18(25)20-16-10-12-22(13-11-16)19(23)24-6-3/h7-9,16H,4-6,10-13H2,1-3H3,(H2,20,21,25)