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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(dimethylamino)benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(dimethylamino)benzamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-4-(dimethylamino)benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(dimethylamino)benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(dimethylamino)benzamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O3S/c1-23(2)19-12-10-17(11-13-19)21(25)22-18-8-7-9-20(16-18)28(26,27)24-14-5-3-4-6-15-24/h7-13,16H,3-6,14-15H2,1-2H3,(H,22,25)