4-(3-ethylsulfanylpropylamino)benzenecarbonitrile

Systemtic Name: 4-(3-ethylsulfanylpropylamino)benzenecarbonitrile Openeye Name: 4-(3-ethylsulfanylpropylamino)benzonitrile CAS Name: 4-[3-(ethylthio)propylamino]benzonitrile IUPAC Name: 4-(3-ethylsulfanylpropylamino)benzonitrile Traditional Name: 4-[3-(ethylthio)propylamino]benzonitrile Formula: C12H16N2S MolecularWeight: 220.33384

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCCNC1=CC=C(C=C1)C#N

Isomeric SMILES

CCSCCCNC1=CC=C(C=C1)C#N

InChI

InChI=1S/C12H16N2S/c1-2-15-9-3-8-14-12-6-4-11(10-13)5-7-12/h4-7,14H,2-3,8-9H2,1H3