3-(2-methyl-3-propyl-quinolin-4-yl)sulfanylpropanenitrile

Systemtic Name: 3-(2-methyl-3-propyl-quinolin-4-yl)sulfanylpropanenitrile Openeye Name: 3-[(2-methyl-3-propyl-4-quinolyl)sulfanyl]propanenitrile CAS Name: 3-[(2-methyl-3-propyl-4-quinolinyl)thio]propanenitrile IUPAC Name: 3-(2-methyl-3-propylquinolin-4-yl)sulfanylpropanenitrile Traditional Name: 3-[(2-methyl-3-propyl-4-quinolyl)thio]propionitrile Formula: C16H18N2S MolecularWeight: 270.39252

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=CC=CC=C2N=C1C)SCCC#N

Isomeric SMILES

CCCC1=C(C2=CC=CC=C2N=C1C)SCCC#N

InChI

InChI=1S/C16H18N2S/c1-3-7-13-12(2)18-15-9-5-4-8-14(15)16(13)19-11-6-10-17/h4-5,8-9H,3,6-7,11H2,1-2H3