3-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-4-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-4-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-4-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-o-anisyl-benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O4S/c1-17-11-12-18(22(25)23-16-19-9-5-6-10-20(19)28-2)15-21(17)29(26,27)24-13-7-3-4-8-14-24/h5-6,9-12,15H,3-4,7-8,13-14,16H2,1-2H3,(H,23,25)