4-(hexylsulfanylmethyl)-N-propan-2-yl-aniline

Systemtic Name: 4-(hexylsulfanylmethyl)-N-propan-2-yl-aniline Openeye Name: 4-(hexylsulfanylmethyl)-N-isopropyl-aniline CAS Name: 4-[(hexylthio)methyl]-N-propan-2-ylaniline IUPAC Name: 4-(hexylsulfanylmethyl)-N-propan-2-ylaniline Traditional Name: [4-[(hexylthio)methyl]phenyl]-isopropyl-amine Formula: C16H27NS MolecularWeight: 265.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSCC1=CC=C(C=C1)NC(C)C

Isomeric SMILES

CCCCCCSCC1=CC=C(C=C1)NC(C)C

InChI

InChI=1S/C16H27NS/c1-4-5-6-7-12-18-13-15-8-10-16(11-9-15)17-14(2)3/h8-11,14,17H,4-7,12-13H2,1-3H3