ethyl 4-[(2-azanyl-5-chloranyl-phenyl)carbamothioylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(2-azanyl-5-chloranyl-phenyl)carbamothioylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(2-amino-5-chloro-phenyl)carbamothioylamino]piperidine-1-carboxylate CAS Name: 4-[[(2-amino-5-chloroanilino)-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-amino-5-chlorophenyl)carbamothioylamino]piperidine-1-carboxylate Traditional Name: 4-[(2-amino-5-chloro-phenyl)thiocarbamoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C15H21ClN4O2S MolecularWeight: 356.87084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21ClN4O2S/c1-2-22-15(21)20-7-5-11(6-8-20)18-14(23)19-13-9-10(16)3-4-12(13)17/h3-4,9,11H,2,5-8,17H2,1H3,(H2,18,19,23)