1-methyl-4-phenyl-2-sulfanyl-piperidine-3-carbonitrile

Systemtic Name: 1-methyl-4-phenyl-2-sulfanyl-piperidine-3-carbonitrile Openeye Name: 1-methyl-4-phenyl-2-sulfanyl-piperidine-3-carbonitrile CAS Name: 2-mercapto-1-methyl-4-phenyl-3-piperidinecarbonitrile IUPAC Name: 1-methyl-4-phenyl-2-sulfanylpiperidine-3-carbonitrile Traditional Name: 2-mercapto-1-methyl-4-phenyl-nipecotonitrile Formula: C13H16N2S MolecularWeight: 232.34454

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1S)C#N)C2=CC=CC=C2

Isomeric SMILES

CN1CCC(C(C1S)C#N)C2=CC=CC=C2

InChI

InChI=1S/C13H16N2S/c1-15-8-7-11(12(9-14)13(15)16)10-5-3-2-4-6-10/h2-6,11-13,16H,7-8H2,1H3