5-(azepan-1-ylsulfonyl)-N-(3-methoxyphenyl)-2-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(3-methoxyphenyl)-2-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(3-methoxyphenyl)-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(3-methoxyphenyl)-2-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(3-methoxyphenyl)-2-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(3-methoxyphenyl)-2-methyl-benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H26N2O4S/c1-16-10-11-19(28(25,26)23-12-5-3-4-6-13-23)15-20(16)21(24)22-17-8-7-9-18(14-17)27-2/h7-11,14-15H,3-6,12-13H2,1-2H3,(H,22,24)