ethyl 4-[(2-methylphenyl)carbamothioylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(2-methylphenyl)carbamothioylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-(o-tolylcarbamothioylamino)piperidine-1-carboxylate CAS Name: 4-[[(2-methylanilino)-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-methylphenyl)carbamothioylamino]piperidine-1-carboxylate Traditional Name: 4-(o-tolylthiocarbamoylamino)piperidine-1-carboxylic acid ethyl ester Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC=CC=C2C

InChI

InChI=1S/C16H23N3O2S/c1-3-21-16(20)19-10-8-13(9-11-19)17-15(22)18-14-7-5-4-6-12(14)2/h4-7,13H,3,8-11H2,1-2H3,(H2,17,18,22)