1-prop-2-enylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-prop-2-enylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-allylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-(prop-2-enylthio)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-prop-2-enylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-(allylthio)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C13H14N2S MolecularWeight: 230.32866

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC=C(C2=C1CCCC2)C#N

Isomeric SMILES

C=CCSC1=NC=C(C2=C1CCCC2)C#N

InChI

InChI=1S/C13H14N2S/c1-2-7-16-13-12-6-4-3-5-11(12)10(8-14)9-15-13/h2,9H,1,3-7H2