4-[3-(3,5-dimethylphenoxy)propylsulfanyl]-3-methyl-aniline

Systemtic Name: 4-[3-(3,5-dimethylphenoxy)propylsulfanyl]-3-methyl-aniline Openeye Name: 4-[3-(3,5-dimethylphenoxy)propylsulfanyl]-3-methyl-aniline CAS Name: 4-[3-(3,5-dimethylphenoxy)propylthio]-3-methylaniline IUPAC Name: 4-[3-(3,5-dimethylphenoxy)propylsulfanyl]-3-methylaniline Traditional Name: [4-[3-(3,5-dimethylphenoxy)propylthio]-3-methyl-phenyl]amine Formula: C18H23NOS MolecularWeight: 301.44632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCSC2=C(C=C(C=C2)N)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCSC2=C(C=C(C=C2)N)C)C

InChI

InChI=1S/C18H23NOS/c1-13-9-14(2)11-17(10-13)20-7-4-8-21-18-6-5-16(19)12-15(18)3/h5-6,9-12H,4,7-8,19H2,1-3H3