5-(azepan-1-ylsulfonyl)-2-methyl-N-[2-(2-methylpropylcarbamoyl)phenyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-[2-(2-methylpropylcarbamoyl)phenyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[2-(isobutylcarbamoyl)phenyl]-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methyl-N-[2-[(2-methylpropylamino)-oxomethyl]phenyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-[2-(2-methylpropylcarbamoyl)phenyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[2-(isobutylcarbamoyl)phenyl]-2-methyl-benzamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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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=C3C(=O)NCC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC=CC=C3C(=O)NCC(C)C

InChI

InChI=1S/C25H33N3O4S/c1-18(2)17-26-24(29)21-10-6-7-11-23(21)27-25(30)22-16-20(13-12-19(22)3)33(31,32)28-14-8-4-5-9-15-28/h6-7,10-13,16,18H,4-5,8-9,14-15,17H2,1-3H3,(H,26,29)(H,27,30)