N,N-dimethyl-1-[2-(4-methylsulfanylphenoxy)-5-[(4-propan-2-ylpiperazin-1-yl)methyl]phenyl]methanamine

Systemtic Name: N,N-dimethyl-1-[2-(4-methylsulfanylphenoxy)-5-[(4-propan-2-ylpiperazin-1-yl)methyl]phenyl]methanamine Openeye Name: 1-[5-[(4-isopropylpiperazin-1-yl)methyl]-2-(4-methylsulfanylphenoxy)phenyl]-N,N-dimethyl-methanamine CAS Name: N,N-dimethyl-1-[2-[4-(methylthio)phenoxy]-5-[(4-propan-2-yl-1-piperazinyl)methyl]phenyl]methanamine IUPAC Name: N,N-dimethyl-1-[2-(4-methylsulfanylphenoxy)-5-[(4-propan-2-ylpiperazin-1-yl)methyl]phenyl]methanamine Traditional Name: [5-[(4-isopropylpiperazino)methyl]-2-[4-(methylthio)phenoxy]benzyl]-dimethyl-amine Formula: C24H35N3OS MolecularWeight: 413.6192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)CC2=CC(=C(C=C2)OC3=CC=C(C=C3)SC)CN(C)C

Isomeric SMILES

CC(C)N1CCN(CC1)CC2=CC(=C(C=C2)OC3=CC=C(C=C3)SC)CN(C)C

InChI

InChI=1S/C24H35N3OS/c1-19(2)27-14-12-26(13-15-27)17-20-6-11-24(21(16-20)18-25(3)4)28-22-7-9-23(29-5)10-8-22/h6-11,16,19H,12-15,17-18H2,1-5H3