3-(1,3-benzothiazol-2-yl)-8-methyl-6-[(4-methylpiperazin-1-yl)methyl]-7-oxidanyl-chromen-4-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-8-methyl-6-[(4-methylpiperazin-1-yl)methyl]-7-oxidanyl-chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-[(4-methylpiperazin-1-yl)methyl]chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-[(4-methyl-1-piperazinyl)methyl]-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-[(4-methylpiperazin-1-yl)methyl]chromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-[(4-methylpiperazino)methyl]chromone Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)CN3CCN(CC3)C)C(=O)C(=CO2)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C2C(=CC(=C1O)CN3CCN(CC3)C)C(=O)C(=CO2)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H23N3O3S/c1-14-20(27)15(12-26-9-7-25(2)8-10-26)11-16-21(28)17(13-29-22(14)16)23-24-18-5-3-4-6-19(18)30-23/h3-6,11,13,27H,7-10,12H2,1-2H3