2-[2-(octan-2-ylamino)phenyl]sulfanylethanamide

Systemtic Name: 2-[2-(octan-2-ylamino)phenyl]sulfanylethanamide Openeye Name: 2-[2-(1-methylheptylamino)phenyl]sulfanylacetamide CAS Name: 2-[[2-(octan-2-ylamino)phenyl]thio]acetamide IUPAC Name: 2-[2-(octan-2-ylamino)phenyl]sulfanylacetamide Traditional Name: 2-[[2-(1-methylheptylamino)phenyl]thio]acetamide Formula: C16H26N2OS MolecularWeight: 294.45544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC1=CC=CC=C1SCC(=O)N

Isomeric SMILES

CCCCCCC(C)NC1=CC=CC=C1SCC(=O)N

InChI

InChI=1S/C16H26N2OS/c1-3-4-5-6-9-13(2)18-14-10-7-8-11-15(14)20-12-16(17)19/h7-8,10-11,13,18H,3-6,9,12H2,1-2H3,(H2,17,19)