4-[[2-[[2-(azepan-1-ylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[[2-[[2-(azepan-1-ylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzamide Openeye Name: 4-[[2-[2-(azepane-1-carbonyl)anilino]-2-oxo-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzamide CAS Name: 4-[[2-[2-[1-azepanyl(oxo)methyl]anilino]-2-oxoethyl]-methylsulfonylamino]-N,N-dimethylbenzamide IUPAC Name: 4-[[2-[2-(azepane-1-carbonyl)anilino]-2-oxoethyl]-methylsulfonylamino]-N,N-dimethylbenzamide Traditional Name: 4-[[2-[2-(azepane-1-carbonyl)anilino]-2-keto-ethyl]-mesyl-amino]-N,N-dimethyl-benzamide Formula: C25H32N4O5S MolecularWeight: 500.61038

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)S(=O)(=O)C

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)S(=O)(=O)C

InChI

InChI=1S/C25H32N4O5S/c1-27(2)24(31)19-12-14-20(15-13-19)29(35(3,33)34)18-23(30)26-22-11-7-6-10-21(22)25(32)28-16-8-4-5-9-17-28/h6-7,10-15H,4-5,8-9,16-18H2,1-3H3,(H,26,30)