ethyl 4-[2-methoxyethyl-[(3-methylsulfanylphenyl)carbamothioyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-methoxyethyl-[(3-methylsulfanylphenyl)carbamothioyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[2-methoxyethyl-[(3-methylsulfanylphenyl)carbamothioyl]amino]piperidine-1-carboxylate CAS Name: 4-[2-methoxyethyl-[[3-(methylthio)anilino]-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-methoxyethyl-[(3-methylsulfanylphenyl)carbamothioyl]amino]piperidine-1-carboxylate Traditional Name: 4-[2-methoxyethyl-[[3-(methylthio)phenyl]thiocarbamoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H29N3O3S2 MolecularWeight: 411.58186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O3S2/c1-4-25-19(23)21-10-8-16(9-11-21)22(12-13-24-2)18(26)20-15-6-5-7-17(14-15)27-3/h5-7,14,16H,4,8-13H2,1-3H3,(H,20,26)