1-chloranyl-4-[isothiocyanato(phenyl)methyl]benzene

Systemtic Name: 1-chloranyl-4-[isothiocyanato(phenyl)methyl]benzene Openeye Name: 1-chloro-4-[isothiocyanato(phenyl)methyl]benzene CAS Name: 1-chloro-4-[isothiocyanato(phenyl)methyl]benzene IUPAC Name: 1-chloro-4-[isothiocyanato(phenyl)methyl]benzene Traditional Name: 1-chloro-4-[isothiocyanato(phenyl)methyl]benzene Formula: C14H10ClNS MolecularWeight: 259.7539

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)N=C=S

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)N=C=S

InChI

InChI=1S/C14H10ClNS/c15-13-8-6-12(7-9-13)14(16-10-17)11-4-2-1-3-5-11/h1-9,14H