3-(azepan-1-ylsulfonyl)-4-chloranyl-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[(5-methyl-2-furyl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-methyl-N-[(5-methyl-2-furanyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[(5-methyl-2-furyl)methyl]benzamide Formula: C20H25ClN2O4S MolecularWeight: 424.9415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(O1)CN(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H25ClN2O4S/c1-15-7-9-17(27-15)14-22(2)20(24)16-8-10-18(21)19(13-16)28(25,26)23-11-5-3-4-6-12-23/h7-10,13H,3-6,11-12,14H2,1-2H3