ethyl N-[(3E)-2-oxidanylidene-3-(phenylmethylidene)cyclopentyl]carbothioylcarbamate

Systemtic Name: ethyl N-[(3E)-2-oxidanylidene-3-(phenylmethylidene)cyclopentyl]carbothioylcarbamate Openeye Name: ethyl N-[(3E)-3-benzylidene-2-oxo-cyclopentanecarbothioyl]carbamate CAS Name: N-[[(3E)-2-oxo-3-(phenylmethylene)cyclopentyl]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(3E)-3-benzylidene-2-oxocyclopentanecarbothioyl]carbamate Traditional Name: N-[(3E)-3-benzal-2-keto-cyclopentanecarbothioyl]carbamic acid ethyl ester Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)C1CCC(=CC2=CC=CC=C2)C1=O

Isomeric SMILES

CCOC(=O)NC(=S)C1CC/C(=C\C2=CC=CC=C2)/C1=O

InChI

InChI=1S/C16H17NO3S/c1-2-20-16(19)17-15(21)13-9-8-12(14(13)18)10-11-6-4-3-5-7-11/h3-7,10,13H,2,8-9H2,1H3,(H,17,19,21)/b12-10+