ethyl 2-[[cyclopentyl(pyridin-2-ylmethyl)carbamothioyl]amino]ethanoate

Systemtic Name: ethyl 2-[[cyclopentyl(pyridin-2-ylmethyl)carbamothioyl]amino]ethanoate Openeye Name: ethyl 2-[[cyclopentyl(2-pyridylmethyl)carbamothioyl]amino]acetate CAS Name: 2-[[[cyclopentyl(2-pyridinylmethyl)amino]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[cyclopentyl(pyridin-2-ylmethyl)carbamothioyl]amino]acetate Traditional Name: 2-[[cyclopentyl(2-pyridylmethyl)thiocarbamoyl]amino]acetic acid ethyl ester Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)N(CC1=CC=CC=N1)C2CCCC2

Isomeric SMILES

CCOC(=O)CNC(=S)N(CC1=CC=CC=N1)C2CCCC2

InChI

InChI=1S/C16H23N3O2S/c1-2-21-15(20)11-18-16(22)19(14-8-3-4-9-14)12-13-7-5-6-10-17-13/h5-7,10,14H,2-4,8-9,11-12H2,1H3,(H,18,22)