1-adamantyl-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-[5-(2-thienyl)-6H-1,3,4-thiadiazin-2-yl]piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-[5-(2-thienyl)-6H-1,3,4-thiadiazin-2-yl]piperazino]methanone Formula: C22H28N4OS2 MolecularWeight: 428.61392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(CS2)C3=CC=CS3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCN1C2=NN=C(CS2)C3=CC=CS3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C22H28N4OS2/c27-20(22-11-15-8-16(12-22)10-17(9-15)13-22)25-3-5-26(6-4-25)21-24-23-18(14-29-21)19-2-1-7-28-19/h1-2,7,15-17H,3-6,8-14H2