[5-(azepan-1-ylsulfonyl)-3-methyl-1-benzofuran-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [5-(azepan-1-ylsulfonyl)-3-methyl-1-benzofuran-2-yl]-piperidin-1-yl-methanone Openeye Name: [5-(azepan-1-ylsulfonyl)-3-methyl-benzofuran-2-yl]-(1-piperidyl)methanone CAS Name: [5-(1-azepanylsulfonyl)-3-methyl-2-benzofuranyl]-(1-piperidinyl)methanone IUPAC Name: [5-(azepan-1-ylsulfonyl)-3-methyl-1-benzofuran-2-yl]-piperidin-1-ylmethanone Traditional Name: [5-(azepan-1-ylsulfonyl)-3-methyl-benzofuran-2-yl]-piperidino-methanone Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)N4CCCCC4

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)N4CCCCC4

InChI

InChI=1S/C21H28N2O4S/c1-16-18-15-17(28(25,26)23-13-7-2-3-8-14-23)9-10-19(18)27-20(16)21(24)22-11-5-4-6-12-22/h9-10,15H,2-8,11-14H2,1H3