[2-[3-(2,5-dimethylphenyl)sulfanylpropoxy]phenyl]methanamine

Systemtic Name: [2-[3-(2,5-dimethylphenyl)sulfanylpropoxy]phenyl]methanamine Openeye Name: [2-[3-(2,5-dimethylphenyl)sulfanylpropoxy]phenyl]methanamine CAS Name: [2-[3-[(2,5-dimethylphenyl)thio]propoxy]phenyl]methanamine IUPAC Name: [2-[3-(2,5-dimethylphenyl)sulfanylpropoxy]phenyl]methanamine Traditional Name: [2-[3-[(2,5-dimethylphenyl)thio]propoxy]benzyl]amine Formula: C18H23NOS MolecularWeight: 301.44632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCCCOC2=CC=CC=C2CN

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCCCOC2=CC=CC=C2CN

InChI

InChI=1S/C18H23NOS/c1-14-8-9-15(2)18(12-14)21-11-5-10-20-17-7-4-3-6-16(17)13-19/h3-4,6-9,12H,5,10-11,13,19H2,1-2H3