3-methyl-4-[(4-methylpiperazin-1-yl)methyl]-1-(phenylsulfonyl)indol-5-ol

Systemtic Name: 3-methyl-4-[(4-methylpiperazin-1-yl)methyl]-1-(phenylsulfonyl)indol-5-ol Openeye Name: 1-(benzenesulfonyl)-3-methyl-4-[(4-methylpiperazin-1-yl)methyl]indol-5-ol CAS Name: 1-(benzenesulfonyl)-3-methyl-4-[(4-methyl-1-piperazinyl)methyl]-5-indolol IUPAC Name: 1-(benzenesulfonyl)-3-methyl-4-[(4-methylpiperazin-1-yl)methyl]indol-5-ol Traditional Name: 1-besyl-3-methyl-4-[(4-methylpiperazino)methyl]indol-5-ol Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C1C(=C(C=C2)O)CN3CCN(CC3)C)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CN(C2=C1C(=C(C=C2)O)CN3CCN(CC3)C)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O3S/c1-16-14-24(28(26,27)17-6-4-3-5-7-17)19-8-9-20(25)18(21(16)19)15-23-12-10-22(2)11-13-23/h3-9,14,25H,10-13,15H2,1-2H3