1-(chloromethyl)-4-(isothiocyanatomethyl)benzene

Systemtic Name: 1-(chloromethyl)-4-(isothiocyanatomethyl)benzene Openeye Name: 1-(chloromethyl)-4-(isothiocyanatomethyl)benzene CAS Name: 1-(chloromethyl)-4-(isothiocyanatomethyl)benzene IUPAC Name: 1-(chloromethyl)-4-(isothiocyanatomethyl)benzene Traditional Name: 1-(chloromethyl)-4-(isothiocyanatomethyl)benzene Formula: C9H8ClNS MolecularWeight: 197.68452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN=C=S)CCl

Isomeric SMILES

C1=CC(=CC=C1CN=C=S)CCl

InChI

InChI=1S/C9H8ClNS/c10-5-8-1-3-9(4-2-8)6-11-7-12/h1-4H,5-6H2