(2S)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenyl-butanamide

Systemtic Name: (2S)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenyl-butanamide Openeye Name: (2S)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenyl-butanamide CAS Name: (2S)-N-[4-(1-azepanylsulfonyl)phenyl]-2-phenylbutanamide IUPAC Name: (2S)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenylbutanamide Traditional Name: (2S)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenyl-butyramide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O3S/c1-2-21(18-10-6-5-7-11-18)22(25)23-19-12-14-20(15-13-19)28(26,27)24-16-8-3-4-9-17-24/h5-7,10-15,21H,2-4,8-9,16-17H2,1H3,(H,23,25)/t21-/m0/s1