N-(1-adamantylmethyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[4-(2-thienylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-(1-adamantylmethyl)-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide Traditional Name: N-(1-adamantylmethyl)-2-[4-(2-thienylsulfonyl)piperazino]acetamide Formula: C21H31N3O3S2 MolecularWeight: 437.61914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC(=O)NCC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C21H31N3O3S2/c25-19(22-15-21-11-16-8-17(12-21)10-18(9-16)13-21)14-23-3-5-24(6-4-23)29(26,27)20-2-1-7-28-20/h1-2,7,16-18H,3-6,8-15H2,(H,22,25)