(1S,2R)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenyl-cyclopropane-1-carboxamide

Systemtic Name: (1S,2R)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenyl-cyclopropane-1-carboxamide Openeye Name: (1S,2R)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenyl-cyclopropanecarboxamide CAS Name: (1S,2R)-N-[4-(1-azepanylsulfonyl)phenyl]-2-phenyl-1-cyclopropanecarboxamide IUPAC Name: (1S,2R)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenylcyclopropane-1-carboxamide Traditional Name: (1S,2R)-N-[4-(azepan-1-ylsulfonyl)phenyl]-2-phenyl-cyclopropanecarboxamide Formula: C22H26N2O3S MolecularWeight: 398.51844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC3C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@H]3C[C@H]3C4=CC=CC=C4

InChI

InChI=1S/C22H26N2O3S/c25-22(21-16-20(21)17-8-4-3-5-9-17)23-18-10-12-19(13-11-18)28(26,27)24-14-6-1-2-7-15-24/h3-5,8-13,20-21H,1-2,6-7,14-16H2,(H,23,25)/t20-,21-/m0/s1