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

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(phenylsulfonyl)propanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(benzenesulfonyl)propanamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-(benzenesulfonyl)propanamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(benzenesulfonyl)propanamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-besyl-propionamide Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5S2/c24-21(14-17-29(25,26)19-8-4-3-5-9-19)22-18-10-12-20(13-11-18)30(27,28)23-15-6-1-2-7-16-23/h3-5,8-13H,1-2,6-7,14-17H2,(H,22,24)