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

Systemtic Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxidanylidene-1,3-benzoxazol-3-yl]-N-[(4-dimethylaminophenyl)methyl]ethanamide Openeye Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-[(4-dimethylaminophenyl)methyl]acetamide CAS Name: 2-[6-(1-azepanylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-[(4-dimethylaminophenyl)methyl]acetamide IUPAC Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-[(4-dimethylaminophenyl)methyl]acetamide Traditional Name: 2-[6-(azepan-1-ylsulfonyl)-2-keto-1,3-benzoxazol-3-yl]-N-[4-(dimethylamino)benzyl]acetamide Formula: C24H30N4O5S MolecularWeight: 486.5838

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCCC4)OC2=O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCCC4)OC2=O

InChI

InChI=1S/C24H30N4O5S/c1-26(2)19-9-7-18(8-10-19)16-25-23(29)17-28-21-12-11-20(15-22(21)33-24(28)30)34(31,32)27-13-5-3-4-6-14-27/h7-12,15H,3-6,13-14,16-17H2,1-2H3,(H,25,29)