2-cyclopentylsulfanyl-N-heptan-2-yl-aniline

Systemtic Name: 2-cyclopentylsulfanyl-N-heptan-2-yl-aniline Openeye Name: 2-cyclopentylsulfanyl-N-(1-methylhexyl)aniline CAS Name: 2-(cyclopentylthio)-N-heptan-2-ylaniline IUPAC Name: 2-cyclopentylsulfanyl-N-heptan-2-ylaniline Traditional Name: [2-(cyclopentylthio)phenyl]-(1-methylhexyl)amine Formula: C18H29NS MolecularWeight: 291.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1=CC=CC=C1SC2CCCC2

Isomeric SMILES

CCCCCC(C)NC1=CC=CC=C1SC2CCCC2

InChI

InChI=1S/C18H29NS/c1-3-4-5-10-15(2)19-17-13-8-9-14-18(17)20-16-11-6-7-12-16/h8-9,13-16,19H,3-7,10-12H2,1-2H3