N-(3-methylpentan-2-yl)-3-methylsulfanyl-aniline

Systemtic Name: N-(3-methylpentan-2-yl)-3-methylsulfanyl-aniline Openeye Name: N-(1,2-dimethylbutyl)-3-methylsulfanyl-aniline CAS Name: N-(3-methylpentan-2-yl)-3-(methylthio)aniline IUPAC Name: N-(3-methylpentan-2-yl)-3-methylsulfanylaniline Traditional Name: 1,2-dimethylbutyl-[3-(methylthio)phenyl]amine Formula: C13H21NS MolecularWeight: 223.37754

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)NC1=CC(=CC=C1)SC

Isomeric SMILES

CCC(C)C(C)NC1=CC(=CC=C1)SC

InChI

InChI=1S/C13H21NS/c1-5-10(2)11(3)14-12-7-6-8-13(9-12)15-4/h6-11,14H,5H2,1-4H3