N-[2,5-bis(oxidanylidene)-1-(4-sulfamoylphenyl)pyrrolidin-3-yl]-N-(pyridin-3-ylmethyl)adamantane-1-carboxamide

Systemtic Name: N-[2,5-bis(oxidanylidene)-1-(4-sulfamoylphenyl)pyrrolidin-3-yl]-N-(pyridin-3-ylmethyl)adamantane-1-carboxamide Openeye Name: N-[2,5-dioxo-1-(4-sulfamoylphenyl)pyrrolidin-3-yl]-N-(3-pyridylmethyl)adamantane-1-carboxamide CAS Name: N-[2,5-dioxo-1-(4-sulfamoylphenyl)-3-pyrrolidinyl]-N-(3-pyridinylmethyl)-1-adamantanecarboxamide IUPAC Name: N-[2,5-dioxo-1-(4-sulfamoylphenyl)pyrrolidin-3-yl]-N-(pyridin-3-ylmethyl)adamantane-1-carboxamide Traditional Name: N-[2,5-diketo-1-(4-sulfamoylphenyl)pyrrolidin-3-yl]-N-(3-pyridylmethyl)adamantane-1-carboxamide Formula: C27H30N4O5S MolecularWeight: 522.6159

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)N(CC4=CN=CC=C4)C5CC(=O)N(C5=O)C6=CC=C(C=C6)S(=O)(=O)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)N(CC4=CN=CC=C4)C5CC(=O)N(C5=O)C6=CC=C(C=C6)S(=O)(=O)N

InChI

InChI=1S/C27H30N4O5S/c28-37(35,36)22-5-3-21(4-6-22)31-24(32)11-23(25(31)33)30(16-17-2-1-7-29-15-17)26(34)27-12-18-8-19(13-27)10-20(9-18)14-27/h1-7,15,18-20,23H,8-14,16H2,(H2,28,35,36)