3-azanylidene-1-methylsulfanyl-2-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 3-azanylidene-1-methylsulfanyl-2-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 3-imino-1-methylsulfanyl-2-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 3-imino-1-(methylthio)-2-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 3-imino-1-methylsulfanyl-2-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 3-imino-1-(methylthio)-2-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C2CCCCC2=C(C(=N)N1C3=CC=CC=C3)C#N

Isomeric SMILES

CSC1=C2CCCCC2=C(C(=N)N1C3=CC=CC=C3)C#N

InChI

InChI=1S/C17H17N3S/c1-21-17-14-10-6-5-9-13(14)15(11-18)16(19)20(17)12-7-3-2-4-8-12/h2-4,7-8,19H,5-6,9-10H2,1H3