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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[4-(diethylamino)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[4-(diethylamino)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[4-(diethylamino)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[4-(diethylamino)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[4-(diethylamino)phenyl]benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H31N3O3S/c1-3-25(4-2)21-14-12-20(13-15-21)24-23(27)19-10-9-11-22(18-19)30(28,29)26-16-7-5-6-8-17-26/h9-15,18H,3-8,16-17H2,1-2H3,(H,24,27)