ethyl 4-[(2-methoxy-5-methyl-phenyl)carbamothioylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(2-methoxy-5-methyl-phenyl)carbamothioylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(2-methoxy-5-methyl-phenyl)carbamothioylamino]piperidine-1-carboxylate CAS Name: 4-[[(2-methoxy-5-methylanilino)-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-methoxy-5-methylphenyl)carbamothioylamino]piperidine-1-carboxylate Traditional Name: 4-[(2-methoxy-5-methyl-phenyl)thiocarbamoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O3S/c1-4-23-17(21)20-9-7-13(8-10-20)18-16(24)19-14-11-12(2)5-6-15(14)22-3/h5-6,11,13H,4,7-10H2,1-3H3,(H2,18,19,24)