N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[2-(diethylamino)-5-(1-piperidylsulfonyl)phenyl]-3-methyl-benzofuran-2-carboxamide CAS Name: N-[2-(diethylamino)-5-(1-piperidinylsulfonyl)phenyl]-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonylphenyl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[2-(diethylamino)-5-piperidinosulfonyl-phenyl]-3-methyl-coumarilamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C4=CC=CC=C4O3)C

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C4=CC=CC=C4O3)C

InChI

InChI=1S/C25H31N3O4S/c1-4-27(5-2)22-14-13-19(33(30,31)28-15-9-6-10-16-28)17-21(22)26-25(29)24-18(3)20-11-7-8-12-23(20)32-24/h7-8,11-14,17H,4-6,9-10,15-16H2,1-3H3,(H,26,29)