4-[2-[4-[methyl-(4-methylphenyl)amino]butylamino]-1-oxidanyl-ethyl]-2-methylsulfinyl-phenol

Systemtic Name: 4-[2-[4-[methyl-(4-methylphenyl)amino]butylamino]-1-oxidanyl-ethyl]-2-methylsulfinyl-phenol Openeye Name: 4-[2-[4-(N,4-dimethylanilino)butylamino]-1-hydroxy-ethyl]-2-methylsulfinyl-phenol CAS Name: 4-[2-[4-(N,4-dimethylanilino)butylamino]-1-hydroxyethyl]-2-methylsulfinylphenol IUPAC Name: 4-[2-[4-(N,4-dimethylanilino)butylamino]-1-hydroxyethyl]-2-methylsulfinylphenol Traditional Name: 4-[2-[4-(N,4-dimethylanilino)butylamino]-1-hydroxy-ethyl]-2-methylsulfinyl-phenol Formula: C21H30N2O3S MolecularWeight: 390.5395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C)CCCCNCC(C2=CC(=C(C=C2)O)S(=O)C)O

Isomeric SMILES

CC1=CC=C(C=C1)N(C)CCCCNCC(C2=CC(=C(C=C2)O)S(=O)C)O

InChI

InChI=1S/C21H30N2O3S/c1-16-6-9-18(10-7-16)23(2)13-5-4-12-22-15-20(25)17-8-11-19(24)21(14-17)27(3)26/h6-11,14,20,22,24-25H,4-5,12-13,15H2,1-3H3