ethyl 1-[(4-propan-2-ylphenyl)carbamothioyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(4-propan-2-ylphenyl)carbamothioyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(4-isopropylphenyl)carbamothioyl]piperidine-3-carboxylate CAS Name: 1-[(4-propan-2-ylanilino)-sulfanylidenemethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-propan-2-ylphenyl)carbamothioyl]piperidine-3-carboxylate Traditional Name: 1-(p-cumenylthiocarbamoyl)nipecotic acid ethyl ester Formula: C18H26N2O2S MolecularWeight: 334.47624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=S)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=S)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C18H26N2O2S/c1-4-22-17(21)15-6-5-11-20(12-15)18(23)19-16-9-7-14(8-10-16)13(2)3/h7-10,13,15H,4-6,11-12H2,1-3H3,(H,19,23)