1-[10-[8-(4-methylpiperazin-1-yl)octyl]phenothiazin-2-yl]butan-1-one

Systemtic Name: 1-[10-[8-(4-methylpiperazin-1-yl)octyl]phenothiazin-2-yl]butan-1-one Openeye Name: 1-[10-[8-(4-methylpiperazin-1-yl)octyl]phenothiazin-2-yl]butan-1-one CAS Name: 1-[10-[8-(4-methyl-1-piperazinyl)octyl]-2-phenothiazinyl]-1-butanone IUPAC Name: 1-[10-[8-(4-methylpiperazin-1-yl)octyl]phenothiazin-2-yl]butan-1-one Traditional Name: 1-[10-[8-(4-methylpiperazino)octyl]phenothiazin-2-yl]butan-1-one Formula: C29H41N3OS MolecularWeight: 479.72034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCCCCCCN4CCN(CC4)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCCCCCCN4CCN(CC4)C

InChI

InChI=1S/C29H41N3OS/c1-3-12-27(33)24-15-16-29-26(23-24)32(25-13-8-9-14-28(25)34-29)18-11-7-5-4-6-10-17-31-21-19-30(2)20-22-31/h8-9,13-16,23H,3-7,10-12,17-22H2,1-2H3