3-methylsulfanyl-N-[(4-propoxyphenyl)methyl]aniline

Systemtic Name: 3-methylsulfanyl-N-[(4-propoxyphenyl)methyl]aniline Openeye Name: 3-methylsulfanyl-N-[(4-propoxyphenyl)methyl]aniline CAS Name: 3-(methylthio)-N-[(4-propoxyphenyl)methyl]aniline IUPAC Name: 3-methylsulfanyl-N-[(4-propoxyphenyl)methyl]aniline Traditional Name: [3-(methylthio)phenyl]-(4-propoxybenzyl)amine Formula: C17H21NOS MolecularWeight: 287.41974

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CNC2=CC(=CC=C2)SC

Isomeric SMILES

CCCOC1=CC=C(C=C1)CNC2=CC(=CC=C2)SC

InChI

InChI=1S/C17H21NOS/c1-3-11-19-16-9-7-14(8-10-16)13-18-15-5-4-6-17(12-15)20-2/h4-10,12,18H,3,11,13H2,1-2H3