[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone

Systemtic Name: [4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone Openeye Name: [4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone CAS Name: [4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-(9H-xanthen-9-yl)methanone IUPAC Name: [4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone Traditional Name: [4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazino]-(9H-xanthen-9-yl)methanone Formula: C27H25N3O4S MolecularWeight: 487.5701

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C27H25N3O4S/c1-32-21-11-12-22(33-2)25-24(21)28-27(35-25)30-15-13-29(14-16-30)26(31)23-17-7-3-5-9-19(17)34-20-10-6-4-8-18(20)23/h3-12,23H,13-16H2,1-2H3