[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone

Systemtic Name: [4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone Openeye Name: [4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone CAS Name: [4-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-(9H-xanthen-9-yl)methanone IUPAC Name: [4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone Traditional Name: [4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazino]-(9H-xanthen-9-yl)methanone Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46)C

InChI

InChI=1S/C27H25N3O2S/c1-17-15-18(2)25-23(16-17)33-27(28-25)30-13-11-29(12-14-30)26(31)24-19-7-3-5-9-21(19)32-22-10-6-4-8-20(22)24/h3-10,15-16,24H,11-14H2,1-2H3