N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(cyclopropylsulfamoyl)benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(cyclopropylsulfamoyl)benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(cyclopropylsulfamoyl)benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-3-(cyclopropylsulfamoyl)benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3-(cyclopropylsulfamoyl)benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(cyclopropylsulfamoyl)benzamide Formula: C23H29N3O5S2 MolecularWeight: 491.62346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3CC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3CC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H29N3O5S2/c1-17-9-10-20(16-22(17)33(30,31)26-13-4-2-3-5-14-26)24-23(27)18-7-6-8-21(15-18)32(28,29)25-19-11-12-19/h6-10,15-16,19,25H,2-5,11-14H2,1H3,(H,24,27)