2-(4-azanylbutyl)-4-(3-propylsulfinylpropyl)benzenecarbonitrile

Systemtic Name: 2-(4-azanylbutyl)-4-(3-propylsulfinylpropyl)benzenecarbonitrile Openeye Name: 2-(4-aminobutyl)-4-(3-propylsulfinylpropyl)benzonitrile CAS Name: 2-(4-aminobutyl)-4-(3-propylsulfinylpropyl)benzonitrile IUPAC Name: 2-(4-aminobutyl)-4-(3-propylsulfinylpropyl)benzonitrile Traditional Name: 2-(4-aminobutyl)-4-(3-propylsulfinylpropyl)benzonitrile Formula: C17H26N2OS MolecularWeight: 306.46614

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)CCCC1=CC(=C(C=C1)C#N)CCCCN

Isomeric SMILES

CCCS(=O)CCCC1=CC(=C(C=C1)C#N)CCCCN

InChI

InChI=1S/C17H26N2OS/c1-2-11-21(20)12-5-6-15-8-9-17(14-19)16(13-15)7-3-4-10-18/h8-9,13H,2-7,10-12,18H2,1H3