2-ethylsulfanyl-6-[1-(isothiocyanatomethyl)cyclopentyl]benzenecarbonitrile

Systemtic Name: 2-ethylsulfanyl-6-[1-(isothiocyanatomethyl)cyclopentyl]benzenecarbonitrile Openeye Name: 2-ethylsulfanyl-6-[1-(isothiocyanatomethyl)cyclopentyl]benzonitrile CAS Name: 2-(ethylthio)-6-[1-(isothiocyanatomethyl)cyclopentyl]benzonitrile IUPAC Name: 2-ethylsulfanyl-6-[1-(isothiocyanatomethyl)cyclopentyl]benzonitrile Traditional Name: 2-(ethylthio)-6-[1-(isothiocyanatomethyl)cyclopentyl]benzonitrile Formula: C16H18N2S2 MolecularWeight: 302.45752

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1C#N)C2(CCCC2)CN=C=S

Isomeric SMILES

CCSC1=CC=CC(=C1C#N)C2(CCCC2)CN=C=S

InChI

InChI=1S/C16H18N2S2/c1-2-20-15-7-5-6-14(13(15)10-17)16(11-18-12-19)8-3-4-9-16/h5-7H,2-4,8-9,11H2,1H3