3-methyl-5-(2-methylpentyl)-2-phenylsulfanyl-pyrazine

Systemtic Name: 3-methyl-5-(2-methylpentyl)-2-phenylsulfanyl-pyrazine Openeye Name: 3-methyl-5-(2-methylpentyl)-2-phenylsulfanyl-pyrazine CAS Name: 3-methyl-5-(2-methylpentyl)-2-(phenylthio)pyrazine IUPAC Name: 3-methyl-5-(2-methylpentyl)-2-phenylsulfanylpyrazine Traditional Name: 3-methyl-5-(2-methylpentyl)-2-(phenylthio)pyrazine Formula: C17H22N2S MolecularWeight: 286.43498

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC1=CN=C(C(=N1)C)SC2=CC=CC=C2

Isomeric SMILES

CCCC(C)CC1=CN=C(C(=N1)C)SC2=CC=CC=C2

InChI

InChI=1S/C17H22N2S/c1-4-8-13(2)11-15-12-18-17(14(3)19-15)20-16-9-6-5-7-10-16/h5-7,9-10,12-13H,4,8,11H2,1-3H3