2,5-dibutoxy-3-(4-methylphenyl)sulfanyl-aniline

Systemtic Name: 2,5-dibutoxy-3-(4-methylphenyl)sulfanyl-aniline Openeye Name: 2,5-dibutoxy-3-(p-tolylsulfanyl)aniline CAS Name: 2,5-dibutoxy-3-[(4-methylphenyl)thio]aniline IUPAC Name: 2,5-dibutoxy-3-(4-methylphenyl)sulfanylaniline Traditional Name: [2,5-dibutoxy-3-(p-tolylthio)phenyl]amine Formula: C21H29NO2S MolecularWeight: 359.52546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C(=C1)N)OCCCC)SC2=CC=C(C=C2)C

Isomeric SMILES

CCCCOC1=CC(=C(C(=C1)N)OCCCC)SC2=CC=C(C=C2)C

InChI

InChI=1S/C21H29NO2S/c1-4-6-12-23-17-14-19(22)21(24-13-7-5-2)20(15-17)25-18-10-8-16(3)9-11-18/h8-11,14-15H,4-7,12-13,22H2,1-3H3