N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(pentanoylamino)benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(pentanoylamino)benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(pentanoylamino)benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-(1-oxopentylamino)benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(pentanoylamino)benzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(valerylamino)benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H31N3O4S/c1-2-3-8-23(28)25-20-11-9-19(10-12-20)24(29)26-21-13-15-22(16-14-21)32(30,31)27-17-6-4-5-7-18-27/h9-16H,2-8,17-18H2,1H3,(H,25,28)(H,26,29)