4-[2-(3-ethanoyl-2H-1,3-benzothiazol-2-yl)phenoxy]-1-(4-methylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-[2-(3-ethanoyl-2H-1,3-benzothiazol-2-yl)phenoxy]-1-(4-methylpiperazin-1-yl)butan-1-one Openeye Name: 4-[2-(3-acetyl-2H-1,3-benzothiazol-2-yl)phenoxy]-1-(4-methylpiperazin-1-yl)butan-1-one CAS Name: 4-[2-(3-acetyl-2H-1,3-benzothiazol-2-yl)phenoxy]-1-(4-methyl-1-piperazinyl)-1-butanone IUPAC Name: 4-[2-(3-acetyl-2H-1,3-benzothiazol-2-yl)phenoxy]-1-(4-methylpiperazin-1-yl)butan-1-one Traditional Name: 4-[2-(3-acetyl-2H-1,3-benzothiazol-2-yl)phenoxy]-1-(4-methylpiperazino)butan-1-one Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(SC2=CC=CC=C21)C3=CC=CC=C3OCCCC(=O)N4CCN(CC4)C

Isomeric SMILES

CC(=O)N1C(SC2=CC=CC=C21)C3=CC=CC=C3OCCCC(=O)N4CCN(CC4)C

InChI

InChI=1S/C24H29N3O3S/c1-18(28)27-20-9-4-6-11-22(20)31-24(27)19-8-3-5-10-21(19)30-17-7-12-23(29)26-15-13-25(2)14-16-26/h3-6,8-11,24H,7,12-17H2,1-2H3