propyl 4-[[2-[(3,4-dimethoxyphenyl)amino]-2-sulfanylidene-ethanoyl]amino]piperidine-1-carboxylate

Systemtic Name: propyl 4-[[2-[(3,4-dimethoxyphenyl)amino]-2-sulfanylidene-ethanoyl]amino]piperidine-1-carboxylate Openeye Name: propyl 4-[[2-(3,4-dimethoxyanilino)-2-thioxo-acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-(3,4-dimethoxyanilino)-1-oxo-2-sulfanylideneethyl]amino]-1-piperidinecarboxylic acid propyl ester IUPAC Name: propyl 4-[[2-(3,4-dimethoxyanilino)-2-sulfanylideneacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(3,4-dimethoxyanilino)-2-thioxo-acetyl]amino]piperidine-1-carboxylic acid propyl ester Formula: C19H27N3O5S MolecularWeight: 409.49978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O5S/c1-4-11-27-19(24)22-9-7-13(8-10-22)20-17(23)18(28)21-14-5-6-15(25-2)16(12-14)26-3/h5-6,12-13H,4,7-11H2,1-3H3,(H,20,23)(H,21,28)