ethyl 4-[(2,4-dimethylphenyl)carbamothioyl-(2-methoxyethyl)amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(2,4-dimethylphenyl)carbamothioyl-(2-methoxyethyl)amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(2,4-dimethylphenyl)carbamothioyl-(2-methoxyethyl)amino]piperidine-1-carboxylate CAS Name: 4-[[(2,4-dimethylanilino)-sulfanylidenemethyl]-(2-methoxyethyl)amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2,4-dimethylphenyl)carbamothioyl-(2-methoxyethyl)amino]piperidine-1-carboxylate Traditional Name: 4-[(2,4-dimethylphenyl)thiocarbamoyl-(2-methoxyethyl)amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N(CCOC)C(=S)NC2=C(C=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N(CCOC)C(=S)NC2=C(C=C(C=C2)C)C

InChI

InChI=1S/C20H31N3O3S/c1-5-26-20(24)22-10-8-17(9-11-22)23(12-13-25-4)19(27)21-18-7-6-15(2)14-16(18)3/h6-7,14,17H,5,8-13H2,1-4H3,(H,21,27)