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

Systemtic Name: 3-[3-(cyclohexylmethylsulfanyl)phenyl]prop-2-yn-1-amine Openeye Name: 3-[3-(cyclohexylmethylsulfanyl)phenyl]prop-2-yn-1-amine CAS Name: 3-[3-(cyclohexylmethylthio)phenyl]-2-propyn-1-amine IUPAC Name: 3-[3-(cyclohexylmethylsulfanyl)phenyl]prop-2-yn-1-amine Traditional Name: 3-[3-(cyclohexylmethylthio)phenyl]prop-2-ynylamine Formula: C16H21NS MolecularWeight: 259.40964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CSC2=CC=CC(=C2)C#CCN

Isomeric SMILES

C1CCC(CC1)CSC2=CC=CC(=C2)C#CCN

InChI

InChI=1S/C16H21NS/c17-11-5-9-14-8-4-10-16(12-14)18-13-15-6-2-1-3-7-15/h4,8,10,12,15H,1-3,6-7,11,13,17H2