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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(4-hydroxyphenyl)benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(4-hydroxyphenyl)benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-4-(4-hydroxyphenyl)benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-4-(4-hydroxyphenyl)benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(4-hydroxyphenyl)benzamide Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)O)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)O)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C26H28N2O4S/c1-19-6-13-23(18-25(19)33(31,32)28-16-4-2-3-5-17-28)27-26(30)22-9-7-20(8-10-22)21-11-14-24(29)15-12-21/h6-15,18,29H,2-5,16-17H2,1H3,(H,27,30)