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

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(3-cyanophenyl)benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(3-cyanophenyl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-(3-cyanophenyl)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(3-cyanophenyl)benzamide Traditional Name: 4-(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=C(C=C2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

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

InChI

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