ethyl 4-[(3,4-dimethylphenyl)carbamothioylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(3,4-dimethylphenyl)carbamothioylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(3,4-dimethylphenyl)carbamothioylamino]piperidine-1-carboxylate CAS Name: 4-[[(3,4-dimethylanilino)-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3,4-dimethylphenyl)carbamothioylamino]piperidine-1-carboxylate Traditional Name: 4-[(3,4-dimethylphenyl)thiocarbamoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C17H25N3O2S/c1-4-22-17(21)20-9-7-14(8-10-20)18-16(23)19-15-6-5-12(2)13(3)11-15/h5-6,11,14H,4,7-10H2,1-3H3,(H2,18,19,23)