1-adamantyl-[4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C23H28ClN3OS MolecularWeight: 430.00592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N3CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N3CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H28ClN3OS/c1-14-2-3-18(24)20-19(14)25-22(29-20)27-6-4-26(5-7-27)21(28)23-11-15-8-16(12-23)10-17(9-15)13-23/h2-3,15-17H,4-13H2,1H3