2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-N-(1-cyanocyclopentyl)ethanamide

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-N-(1-cyanocyclopentyl)ethanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-N-(1-cyanocyclopentyl)acetamide CAS Name: 2-[4-(1-azepanylsulfonyl)anilino]-N-(1-cyanocyclopentyl)acetamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-N-(1-cyanocyclopentyl)acetamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-N-(1-cyanocyclopentyl)acetamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)NC3(CCCC3)C#N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)NC3(CCCC3)C#N

InChI

InChI=1S/C20H28N4O3S/c21-16-20(11-3-4-12-20)23-19(25)15-22-17-7-9-18(10-8-17)28(26,27)24-13-5-1-2-6-14-24/h7-10,22H,1-6,11-15H2,(H,23,25)