3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(cyclopentylmethyl)propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(cyclopentylmethyl)propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(cyclopentylmethyl)propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-(cyclopentylmethyl)propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(cyclopentylmethyl)propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(cyclopentylmethyl)propionamide Formula: C21H32N2O3S MolecularWeight: 392.55538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3CCCC3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3CCCC3

InChI

InChI=1S/C21H32N2O3S/c24-21(22-17-19-7-3-4-8-19)14-11-18-9-12-20(13-10-18)27(25,26)23-15-5-1-2-6-16-23/h9-10,12-13,19H,1-8,11,14-17H2,(H,22,24)