2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-N-(3-fluorophenyl)acetamide CAS Name: 2-[4-(1-azepanylsulfonyl)anilino]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-N-(3-fluorophenyl)acetamide Formula: C20H24FN3O3S MolecularWeight: 405.486263

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C20H24FN3O3S/c21-16-6-5-7-18(14-16)23-20(25)15-22-17-8-10-19(11-9-17)28(26,27)24-12-3-1-2-4-13-24/h5-11,14,22H,1-4,12-13,15H2,(H,23,25)