N-[2-oxidanylidene-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-oxo-2-(4-tetralin-6-ylsulfonylpiperazin-1-yl)ethyl]adamantane-1-carboxamide CAS Name: N-[2-oxo-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-oxo-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-keto-2-(4-tetralin-6-ylsulfonylpiperazino)ethyl]adamantane-1-carboxamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)CNC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)CNC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H37N3O4S/c31-25(18-28-26(32)27-15-19-11-20(16-27)13-21(12-19)17-27)29-7-9-30(10-8-29)35(33,34)24-6-5-22-3-1-2-4-23(22)14-24/h5-6,14,19-21H,1-4,7-13,15-18H2,(H,28,32)