2-(1-isocyanoethyl)-4-methyl-1-methylsulfanyl-benzene

Systemtic Name: 2-(1-isocyanoethyl)-4-methyl-1-methylsulfanyl-benzene Openeye Name: 2-(1-isocyanoethyl)-4-methyl-1-methylsulfanyl-benzene CAS Name: 2-(1-isocyanoethyl)-4-methyl-1-(methylthio)benzene IUPAC Name: 2-(1-isocyanoethyl)-4-methyl-1-methylsulfanylbenzene Traditional Name: 2-(1-isocyanoethyl)-4-methyl-1-(methylthio)benzene Formula: C11H13NS MolecularWeight: 191.29262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NS/c1-8-5-6-11(13-4)10(7-8)9(2)12-3/h5-7,9H,1-2,4H3