N-[1-[4-(cyclopropylcarbamoyl)phenyl]sulfonylpiperidin-4-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[4-(cyclopropylcarbamoyl)phenyl]sulfonylpiperidin-4-yl]adamantane-1-carboxamide Openeye Name: N-[1-[4-(cyclopropylcarbamoyl)phenyl]sulfonyl-4-piperidyl]adamantane-1-carboxamide CAS Name: N-[1-[4-[(cyclopropylamino)-oxomethyl]phenyl]sulfonyl-4-piperidinyl]-1-adamantanecarboxamide IUPAC Name: N-[1-[4-(cyclopropylcarbamoyl)phenyl]sulfonylpiperidin-4-yl]adamantane-1-carboxamide Traditional Name: N-[1-[4-(cyclopropylcarbamoyl)phenyl]sulfonyl-4-piperidyl]adamantane-1-carboxamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H35N3O4S/c30-24(27-21-3-4-21)20-1-5-23(6-2-20)34(32,33)29-9-7-22(8-10-29)28-25(31)26-14-17-11-18(15-26)13-19(12-17)16-26/h1-2,5-6,17-19,21-22H,3-4,7-16H2,(H,27,30)(H,28,31)