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

Systemtic Name: 4-cyclopentylsulfanyl-N-heptan-2-yl-aniline Openeye Name: 4-cyclopentylsulfanyl-N-(1-methylhexyl)aniline CAS Name: 4-(cyclopentylthio)-N-heptan-2-ylaniline IUPAC Name: 4-cyclopentylsulfanyl-N-heptan-2-ylaniline Traditional Name: [4-(cyclopentylthio)phenyl]-(1-methylhexyl)amine Formula: C18H29NS MolecularWeight: 291.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1=CC=C(C=C1)SC2CCCC2

Isomeric SMILES

CCCCCC(C)NC1=CC=C(C=C1)SC2CCCC2

InChI

InChI=1S/C18H29NS/c1-3-4-5-8-15(2)19-16-11-13-18(14-12-16)20-17-9-6-7-10-17/h11-15,17,19H,3-10H2,1-2H3