2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(4-ethoxy-3-methoxy-phenyl)-3-methyl-pentanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(4-ethoxy-3-methoxy-phenyl)-3-methyl-pentanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(4-ethoxy-3-methoxy-phenyl)-3-methyl-pentanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(4-ethoxy-3-methoxyphenyl)-3-methylpentanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(4-ethoxy-3-methoxyphenyl)-3-methylpentanamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(4-ethoxy-3-methoxy-phenyl)-3-methyl-valeramide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC(=C(C=C1)OCC)OC)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC(=C(C=C1)OCC)OC)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C22H27N3O5S/c1-5-14(3)20(24-21-16-9-7-8-10-19(16)31(27,28)25-21)22(26)23-15-11-12-17(30-6-2)18(13-15)29-4/h7-14,20H,5-6H2,1-4H3,(H,23,26)(H,24,25)