N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3,5-dimethyl-benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3,5-dimethyl-benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-3,5-dimethylbenzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3,5-dimethylbenzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3,5-dimethyl-benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)C)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)C)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O3S/c1-16-12-17(2)14-19(13-16)22(25)23-20-9-8-18(3)21(15-20)28(26,27)24-10-6-4-5-7-11-24/h8-9,12-15H,4-7,10-11H2,1-3H3,(H,23,25)