1-(1-isocyanoethyl)-2-[(2-methylphenyl)methylsulfanyl]benzene

Systemtic Name: 1-(1-isocyanoethyl)-2-[(2-methylphenyl)methylsulfanyl]benzene Openeye Name: 1-(1-isocyanoethyl)-2-(o-tolylmethylsulfanyl)benzene CAS Name: 1-(1-isocyanoethyl)-2-[(2-methylphenyl)methylthio]benzene IUPAC Name: 1-(1-isocyanoethyl)-2-[(2-methylphenyl)methylsulfanyl]benzene Traditional Name: 1-(1-isocyanoethyl)-2-[(2-methylbenzyl)thio]benzene Formula: C17H17NS MolecularWeight: 267.38858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=CC=CC=C2C(C)[N+]#[C-]

Isomeric SMILES

CC1=CC=CC=C1CSC2=CC=CC=C2C(C)[N+]#[C-]

InChI

InChI=1S/C17H17NS/c1-13-8-4-5-9-15(13)12-19-17-11-7-6-10-16(17)14(2)18-3/h4-11,14H,12H2,1-2H3