4-ethyl-2-(3-oxidanylpropoxy)-3-(3-propylsulfinylpropylamino)benzenecarbonitrile

Systemtic Name: 4-ethyl-2-(3-oxidanylpropoxy)-3-(3-propylsulfinylpropylamino)benzenecarbonitrile Openeye Name: 4-ethyl-2-(3-hydroxypropoxy)-3-(3-propylsulfinylpropylamino)benzonitrile CAS Name: 4-ethyl-2-(3-hydroxypropoxy)-3-(3-propylsulfinylpropylamino)benzonitrile IUPAC Name: 4-ethyl-2-(3-hydroxypropoxy)-3-(3-propylsulfinylpropylamino)benzonitrile Traditional Name: 4-ethyl-2-(3-hydroxypropoxy)-3-(3-propylsulfinylpropylamino)benzonitrile Formula: C18H28N2O3S MolecularWeight: 352.49152

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)CCCNC1=C(C=CC(=C1OCCCO)C#N)CC

Isomeric SMILES

CCCS(=O)CCCNC1=C(C=CC(=C1OCCCO)C#N)CC

InChI

InChI=1S/C18H28N2O3S/c1-3-12-24(22)13-5-9-20-17-15(4-2)7-8-16(14-19)18(17)23-11-6-10-21/h7-8,20-21H,3-6,9-13H2,1-2H3