[4-(butan-2-ylsulfanylmethyl)phenyl]methanamine

Systemtic Name: [4-(butan-2-ylsulfanylmethyl)phenyl]methanamine Openeye Name: [4-(sec-butylsulfanylmethyl)phenyl]methanamine CAS Name: [4-[(butan-2-ylthio)methyl]phenyl]methanamine IUPAC Name: [4-(butan-2-ylsulfanylmethyl)phenyl]methanamine Traditional Name: [4-[(sec-butylthio)methyl]benzyl]amine Formula: C12H19NS MolecularWeight: 209.35096

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC1=CC=C(C=C1)CN

Isomeric SMILES

CCC(C)SCC1=CC=C(C=C1)CN

InChI

InChI=1S/C12H19NS/c1-3-10(2)14-9-12-6-4-11(8-13)5-7-12/h4-7,10H,3,8-9,13H2,1-2H3