1-adamantyl-[4-(6-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-(6-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-(6-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-(6-chloro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-(6-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-(6-chloro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C22H26ClN3OS MolecularWeight: 415.97934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C22H26ClN3OS/c23-17-1-2-18-19(10-17)28-21(24-18)26-5-3-25(4-6-26)20(27)22-11-14-7-15(12-22)9-16(8-14)13-22/h1-2,10,14-16H,3-9,11-13H2