1-adamantyl-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: 1-adamantyl-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: 1-adamantyl-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: 1-adamantyl-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: 1-adamantyl-[4-(2-thenyl)-1,4-diazepan-1-yl]methanone Formula: C21H30N2OS MolecularWeight: 358.5407

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC=CS5

Isomeric SMILES

C1CN(CCN(C1)C(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC=CS5

InChI

InChI=1S/C21H30N2OS/c24-20(21-12-16-9-17(13-21)11-18(10-16)14-21)23-5-2-4-22(6-7-23)15-19-3-1-8-25-19/h1,3,8,16-18H,2,4-7,9-15H2