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

Systemtic Name: 4-chloranyl-2-(1-isocyanoethyl)-1-methylsulfanyl-benzene Openeye Name: 4-chloro-2-(1-isocyanoethyl)-1-methylsulfanyl-benzene CAS Name: 4-chloro-2-(1-isocyanoethyl)-1-(methylthio)benzene IUPAC Name: 4-chloro-2-(1-isocyanoethyl)-1-methylsulfanylbenzene Traditional Name: 4-chloro-2-(1-isocyanoethyl)-1-(methylthio)benzene Formula: C10H10ClNS MolecularWeight: 211.7111

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClNS/c1-7(12-2)9-6-8(11)4-5-10(9)13-3/h4-7H,1,3H3