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

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

Systemtic Name:4-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]benzamide
Openeye Name:4-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]benzamide
CAS Name:4-acetamido-N-[4-(1-azepanylsulfonyl)phenyl]benzamide
IUPAC Name:4-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]benzamide
Traditional Name:4-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]benzamide
Formula: C21H25N3O4S
MolecularWeight: 415.5059
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H25N3O4S/c1-16(25)22-18-8-6-17(7-9-18)21(26)23-19-10-12-20(13-11-19)29(27,28)24-14-4-2-3-5-15-24/h6-13H,2-5,14-15H2,1H3,(H,22,25)(H,23,26)


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