5-methyl-2-[2-(propylaminomethyl)phenyl]sulfanyl-aniline

Systemtic Name: 5-methyl-2-[2-(propylaminomethyl)phenyl]sulfanyl-aniline Openeye Name: 5-methyl-2-[2-(propylaminomethyl)phenyl]sulfanyl-aniline CAS Name: 5-methyl-2-[[2-(propylaminomethyl)phenyl]thio]aniline IUPAC Name: 5-methyl-2-[2-(propylaminomethyl)phenyl]sulfanylaniline Traditional Name: [2-[(2-amino-4-methyl-phenyl)thio]benzyl]-propyl-amine Formula: C17H22N2S MolecularWeight: 286.43498

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC=CC=C1SC2=C(C=C(C=C2)C)N

Isomeric SMILES

CCCNCC1=CC=CC=C1SC2=C(C=C(C=C2)C)N

InChI

InChI=1S/C17H22N2S/c1-3-10-19-12-14-6-4-5-7-16(14)20-17-9-8-13(2)11-15(17)18/h4-9,11,19H,3,10,12,18H2,1-2H3