N-(3-chloranyl-4-methyl-phenyl)-3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-3-methyl-5-(1-piperidylsulfonyl)benzofuran-2-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-3-methyl-5-(1-piperidinylsulfonyl)-2-benzofurancarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-3-methyl-5-piperidinosulfonyl-coumarilamide Formula: C22H23ClN2O4S MolecularWeight: 446.94702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCC4)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCC4)C)Cl

InChI

InChI=1S/C22H23ClN2O4S/c1-14-6-7-16(12-19(14)23)24-22(26)21-15(2)18-13-17(8-9-20(18)29-21)30(27,28)25-10-4-3-5-11-25/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,24,26)