N-[4-(azepan-1-yl)phenyl]-3-(4-fluorophenyl)sulfonyl-propanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-3-(4-fluorophenyl)sulfonyl-propanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-3-(4-fluorophenyl)sulfonyl-propanamide CAS Name: N-[4-(1-azepanyl)phenyl]-3-(4-fluorophenyl)sulfonylpropanamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-3-(4-fluorophenyl)sulfonylpropanamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-3-(4-fluorophenyl)sulfonyl-propionamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2O3S/c22-17-5-11-20(12-6-17)28(26,27)16-13-21(25)23-18-7-9-19(10-8-18)24-14-3-1-2-4-15-24/h5-12H,1-4,13-16H2,(H,23,25)