ethyl 1-[(2-propan-2-yloxyphenyl)carbonylcarbamothioyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2-propan-2-yloxyphenyl)carbonylcarbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(2-isopropoxybenzoyl)carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[[oxo-(2-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-propan-2-yloxybenzoyl)carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[(2-isopropoxybenzoyl)thiocarbamoyl]isonipecotic acid ethyl ester Formula: C19H26N2O4S MolecularWeight: 378.48574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)C2=CC=CC=C2OC(C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)C2=CC=CC=C2OC(C)C

InChI

InChI=1S/C19H26N2O4S/c1-4-24-18(23)14-9-11-21(12-10-14)19(26)20-17(22)15-7-5-6-8-16(15)25-13(2)3/h5-8,13-14H,4,9-12H2,1-3H3,(H,20,22,26)