ethyl N-[3-(phenylmethylidene)-2-piperidin-1-yl-cyclopenten-1-yl]carbothioylcarbamate

Systemtic Name: ethyl N-[3-(phenylmethylidene)-2-piperidin-1-yl-cyclopenten-1-yl]carbothioylcarbamate Openeye Name: ethyl N-[3-benzylidene-2-(1-piperidyl)cyclopentene-1-carbothioyl]carbamate CAS Name: N-[[3-(phenylmethylene)-2-(1-piperidinyl)-1-cyclopentenyl]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-(3-benzylidene-2-piperidin-1-ylcyclopentene-1-carbothioyl)carbamate Traditional Name: N-(3-benzal-2-piperidino-cyclopentene-1-carbothioyl)carbamic acid ethyl ester Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)C1=C(C(=CC2=CC=CC=C2)CC1)N3CCCCC3

Isomeric SMILES

CCOC(=O)NC(=S)C1=C(C(=CC2=CC=CC=C2)CC1)N3CCCCC3

InChI

InChI=1S/C21H26N2O2S/c1-2-25-21(24)22-20(26)18-12-11-17(15-16-9-5-3-6-10-16)19(18)23-13-7-4-8-14-23/h3,5-6,9-10,15H,2,4,7-8,11-14H2,1H3,(H,22,24,26)