3-[3-(2-ethylbutylsulfanyl)phenyl]prop-2-yn-1-amine

Systemtic Name: 3-[3-(2-ethylbutylsulfanyl)phenyl]prop-2-yn-1-amine Openeye Name: 3-[3-(2-ethylbutylsulfanyl)phenyl]prop-2-yn-1-amine CAS Name: 3-[3-(2-ethylbutylthio)phenyl]-2-propyn-1-amine IUPAC Name: 3-[3-(2-ethylbutylsulfanyl)phenyl]prop-2-yn-1-amine Traditional Name: 3-[3-(2-ethylbutylthio)phenyl]prop-2-ynylamine Formula: C15H21NS MolecularWeight: 247.39894

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CSC1=CC=CC(=C1)C#CCN

Isomeric SMILES

CCC(CC)CSC1=CC=CC(=C1)C#CCN

InChI

InChI=1S/C15H21NS/c1-3-13(4-2)12-17-15-9-5-7-14(11-15)8-6-10-16/h5,7,9,11,13H,3-4,10,12,16H2,1-2H3