3-methyl-5-(3-methylpiperidin-1-yl)sulfonyl-N-(pyridin-3-ylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-methyl-5-(3-methylpiperidin-1-yl)sulfonyl-N-(pyridin-3-ylmethyl)-1-benzofuran-2-carboxamide Openeye Name: 3-methyl-5-[(3-methyl-1-piperidyl)sulfonyl]-N-(3-pyridylmethyl)benzofuran-2-carboxamide CAS Name: 3-methyl-5-[(3-methyl-1-piperidinyl)sulfonyl]-N-(3-pyridinylmethyl)-2-benzofurancarboxamide IUPAC Name: 3-methyl-5-(3-methylpiperidin-1-yl)sulfonyl-N-(pyridin-3-ylmethyl)-1-benzofuran-2-carboxamide Traditional Name: 3-methyl-5-(3-methylpiperidino)sulfonyl-N-(3-pyridylmethyl)coumarilamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H25N3O4S/c1-15-5-4-10-25(14-15)30(27,28)18-7-8-20-19(11-18)16(2)21(29-20)22(26)24-13-17-6-3-9-23-12-17/h3,6-9,11-12,15H,4-5,10,13-14H2,1-2H3,(H,24,26)