2-[(4-bromophenyl)sulfanylmethyl]-5-methoxy-3-[(4-methylpiperazin-1-yl)methyl]-1H-indole

Systemtic Name: 2-[(4-bromophenyl)sulfanylmethyl]-5-methoxy-3-[(4-methylpiperazin-1-yl)methyl]-1H-indole Openeye Name: 2-[(4-bromophenyl)sulfanylmethyl]-5-methoxy-3-[(4-methylpiperazin-1-yl)methyl]-1H-indole CAS Name: 2-[[(4-bromophenyl)thio]methyl]-5-methoxy-3-[(4-methyl-1-piperazinyl)methyl]-1H-indole IUPAC Name: 2-[(4-bromophenyl)sulfanylmethyl]-5-methoxy-3-[(4-methylpiperazin-1-yl)methyl]-1H-indole Traditional Name: 2-[[(4-bromophenyl)thio]methyl]-5-methoxy-3-[(4-methylpiperazino)methyl]-1H-indole Formula: C22H26BrN3OS MolecularWeight: 460.43034

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(NC3=C2C=C(C=C3)OC)CSC4=CC=C(C=C4)Br

Isomeric SMILES

CN1CCN(CC1)CC2=C(NC3=C2C=C(C=C3)OC)CSC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H26BrN3OS/c1-25-9-11-26(12-10-25)14-20-19-13-17(27-2)5-8-21(19)24-22(20)15-28-18-6-3-16(23)4-7-18/h3-8,13,24H,9-12,14-15H2,1-2H3