N-[[1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperidin-4-yl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperidin-4-yl]methyl]adamantane-1-carboxamide Openeye Name: N-[[1-(3-benzyl-1,2,4-thiadiazol-5-yl)-4-piperidyl]methyl]adamantane-1-carboxamide CAS Name: N-[[1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-4-piperidinyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[1-(3-benzyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]adamantane-1-carboxamide Traditional Name: N-[[1-(3-benzyl-1,2,4-thiadiazol-5-yl)-4-piperidyl]methyl]adamantane-1-carboxamide Formula: C26H34N4OS MolecularWeight: 450.63936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C23CC4CC(C2)CC(C4)C3)C5=NC(=NS5)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1CNC(=O)C23CC4CC(C2)CC(C4)C3)C5=NC(=NS5)CC6=CC=CC=C6

InChI

InChI=1S/C26H34N4OS/c31-24(26-14-20-10-21(15-26)12-22(11-20)16-26)27-17-19-6-8-30(9-7-19)25-28-23(29-32-25)13-18-4-2-1-3-5-18/h1-5,19-22H,6-17H2,(H,27,31)