1-adamantyl-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-[4-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethyl]ammonium Formula: C24H32N3OS+ MolecularWeight: 410.59538

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C[NH2+]C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C[NH2+]C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C24H31N3OS/c28-22(15-25-24-12-16-9-17(13-24)11-18(10-16)14-24)27-7-5-19(6-8-27)23-26-20-3-1-2-4-21(20)29-23/h1-4,16-19,25H,5-15H2/p+1