N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]adamantane-1-carboxamide Openeye Name: N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]adamantane-1-carboxamide CAS Name: N-[3-[(4-methoxyphenyl)sulfamoyl]-4-(1-pyrrolidinyl)phenyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-ylphenyl]adamantane-1-carboxamide Traditional Name: N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidino-phenyl]adamantane-1-carboxamide Formula: C28H35N3O4S MolecularWeight: 509.6602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)N6CCCC6

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)N6CCCC6

InChI

InChI=1S/C28H35N3O4S/c1-35-24-7-4-22(5-8-24)30-36(33,34)26-15-23(6-9-25(26)31-10-2-3-11-31)29-27(32)28-16-19-12-20(17-28)14-21(13-19)18-28/h4-9,15,19-21,30H,2-3,10-14,16-18H2,1H3,(H,29,32)