1-adamantyl-[4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-(3-benzyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-(3-benzyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-(3-benzyl-1,2,4-thiadiazol-5-yl)piperazino]methanone Formula: C24H30N4OS MolecularWeight: 422.5862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NS2)CC3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCN1C2=NC(=NS2)CC3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C24H30N4OS/c29-22(24-14-18-10-19(15-24)12-20(11-18)16-24)27-6-8-28(9-7-27)23-25-21(26-30-23)13-17-4-2-1-3-5-17/h1-5,18-20H,6-16H2