2-(3-phenylpropylsulfanylcarbothioylsulfanyl)ethanenitrile

Systemtic Name: 2-(3-phenylpropylsulfanylcarbothioylsulfanyl)ethanenitrile Openeye Name: 2-(3-phenylpropylsulfanylcarbothioylsulfanyl)acetonitrile CAS Name: 2-[[(3-phenylpropylthio)-sulfanylidenemethyl]thio]acetonitrile IUPAC Name: 2-(3-phenylpropylsulfanylcarbothioylsulfanyl)acetonitrile Traditional Name: 2-[(3-phenylpropylthio)carbothioylthio]acetonitrile Formula: C12H13NS3 MolecularWeight: 267.43332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCSC(=S)SCC#N

Isomeric SMILES

C1=CC=C(C=C1)CCCSC(=S)SCC#N

InChI

InChI=1S/C12H13NS3/c13-8-10-16-12(14)15-9-4-7-11-5-2-1-3-6-11/h1-3,5-6H,4,7,9-10H2