2-[6-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[(4-chlorophenyl)methyl]ethanamide

Systemtic Name: 2-[6-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[(4-chlorophenyl)methyl]ethanamide Openeye Name: 2-[6-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzoxazin-4-yl]-N-[(4-chlorophenyl)methyl]acetamide CAS Name: 2-[6-(1-azepanylsulfonyl)-3-oxo-1,4-benzoxazin-4-yl]-N-[(4-chlorophenyl)methyl]acetamide IUPAC Name: 2-[6-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzoxazin-4-yl]-N-[(4-chlorophenyl)methyl]acetamide Traditional Name: 2-[6-(azepan-1-ylsulfonyl)-3-keto-1,4-benzoxazin-4-yl]-N-(4-chlorobenzyl)acetamide Formula: C23H26ClN3O5S MolecularWeight: 491.98764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H26ClN3O5S/c24-18-7-5-17(6-8-18)14-25-22(28)15-27-20-13-19(9-10-21(20)32-16-23(27)29)33(30,31)26-11-3-1-2-4-12-26/h5-10,13H,1-4,11-12,14-16H2,(H,25,28)