3-(azepan-1-ylsulfonyl)-N-(3-cyanophenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(3-cyanophenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(3-cyanophenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(3-cyanophenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(3-cyanophenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(3-cyanophenyl)benzamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H21N3O3S/c21-15-16-7-5-9-18(13-16)22-20(24)17-8-6-10-19(14-17)27(25,26)23-11-3-1-2-4-12-23/h5-10,13-14H,1-4,11-12H2,(H,22,24)