[[2-(2-ethoxyethylamino)pyridin-3-yl]carbamothioylamino] piperidine-1-carboxylate

Systemtic Name: [[2-(2-ethoxyethylamino)pyridin-3-yl]carbamothioylamino] piperidine-1-carboxylate Openeye Name: [[2-(2-ethoxyethylamino)-3-pyridyl]carbamothioylamino] piperidine-1-carboxylate CAS Name: 1-piperidinecarboxylic acid [[[[2-(2-ethoxyethylamino)-3-pyridinyl]amino]-sulfanylidenemethyl]amino] ester IUPAC Name: [[2-(2-ethoxyethylamino)pyridin-3-yl]carbamothioylamino] piperidine-1-carboxylate Traditional Name: piperidine-1-carboxylic acid [[2-(2-ethoxyethylamino)-3-pyridyl]thiocarbamoylamino] ester Formula: C16H25N5O3S MolecularWeight: 367.4664

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCNC1=C(C=CC=N1)NC(=S)NOC(=O)N2CCCCC2

Isomeric SMILES

CCOCCNC1=C(C=CC=N1)NC(=S)NOC(=O)N2CCCCC2

InChI

InChI=1S/C16H25N5O3S/c1-2-23-12-9-18-14-13(7-6-8-17-14)19-15(25)20-24-16(22)21-10-4-3-5-11-21/h6-8H,2-5,9-12H2,1H3,(H,17,18)(H2,19,20,25)