2-chloranyl-1-[1-(isothiocyanatomethyl)cyclohexyl]-3-methylsulfanyl-benzene

Systemtic Name: 2-chloranyl-1-[1-(isothiocyanatomethyl)cyclohexyl]-3-methylsulfanyl-benzene Openeye Name: 2-chloro-1-[1-(isothiocyanatomethyl)cyclohexyl]-3-methylsulfanyl-benzene CAS Name: 2-chloro-1-[1-(isothiocyanatomethyl)cyclohexyl]-3-(methylthio)benzene IUPAC Name: 2-chloro-1-[1-(isothiocyanatomethyl)cyclohexyl]-3-methylsulfanylbenzene Traditional Name: 2-chloro-1-[1-(isothiocyanatomethyl)cyclohexyl]-3-(methylthio)benzene Formula: C15H18ClNS2 MolecularWeight: 311.89312

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1Cl)C2(CCCCC2)CN=C=S

Isomeric SMILES

CSC1=CC=CC(=C1Cl)C2(CCCCC2)CN=C=S

InChI

InChI=1S/C15H18ClNS2/c1-19-13-7-5-6-12(14(13)16)15(10-17-11-18)8-3-2-4-9-15/h5-7H,2-4,8-10H2,1H3