1-[isocyano-(4-methylphenyl)sulfanyl-methyl]-3-methylsulfanyl-benzene

Systemtic Name: 1-[isocyano-(4-methylphenyl)sulfanyl-methyl]-3-methylsulfanyl-benzene Openeye Name: 1-[isocyano-(3-methylsulfanylphenyl)methyl]sulfanyl-4-methyl-benzene CAS Name: 1-[isocyano-[(4-methylphenyl)thio]methyl]-3-(methylthio)benzene IUPAC Name: 1-[isocyano-(4-methylphenyl)sulfanylmethyl]-3-methylsulfanylbenzene Traditional Name: 1-[[isocyano-[3-(methylthio)phenyl]methyl]thio]-4-methyl-benzene Formula: C16H15NS2 MolecularWeight: 285.427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C2=CC(=CC=C2)SC)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)SC(C2=CC(=CC=C2)SC)[N+]#[C-]

InChI

InChI=1S/C16H15NS2/c1-12-7-9-14(10-8-12)19-16(17-2)13-5-4-6-15(11-13)18-3/h4-11,16H,1,3H3