N-(3-propan-2-ylsulfanylphenoxy)undecan-4-amine

Systemtic Name: N-(3-propan-2-ylsulfanylphenoxy)undecan-4-amine Openeye Name: N-(3-isopropylsulfanylphenoxy)undecan-4-amine CAS Name: N-[3-(propan-2-ylthio)phenoxy]-4-undecanamine IUPAC Name: N-(3-propan-2-ylsulfanylphenoxy)undecan-4-amine Traditional Name: [3-(isopropylthio)phenoxy]-(1-propyloctyl)amine Formula: C20H35NOS MolecularWeight: 337.563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCC)NOC1=CC(=CC=C1)SC(C)C

Isomeric SMILES

CCCCCCCC(CCC)NOC1=CC(=CC=C1)SC(C)C

InChI

InChI=1S/C20H35NOS/c1-5-7-8-9-10-13-18(12-6-2)21-22-19-14-11-15-20(16-19)23-17(3)4/h11,14-18,21H,5-10,12-13H2,1-4H3