1-(1-isothiocyanatoethyl)-4-phenethyl-benzene

Systemtic Name: 1-(1-isothiocyanatoethyl)-4-phenethyl-benzene Openeye Name: 1-(1-isothiocyanatoethyl)-4-phenethyl-benzene CAS Name: 1-(1-isothiocyanatoethyl)-4-phenethylbenzene IUPAC Name: 1-(1-isothiocyanatoethyl)-4-phenethylbenzene Traditional Name: 1-(1-isothiocyanatoethyl)-4-phenethyl-benzene Formula: C17H17NS MolecularWeight: 267.38858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)CCC2=CC=CC=C2)N=C=S

Isomeric SMILES

CC(C1=CC=C(C=C1)CCC2=CC=CC=C2)N=C=S

InChI

InChI=1S/C17H17NS/c1-14(18-13-19)17-11-9-16(10-12-17)8-7-15-5-3-2-4-6-15/h2-6,9-12,14H,7-8H2,1H3