2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-methyl-amino]-N-(3-cyanophenyl)ethanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-methyl-amino]-N-(3-cyanophenyl)ethanamide Openeye Name: N-(3-cyanophenyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methyl-amino]acetamide CAS Name: N-(3-cyanophenyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methylamino]acetamide IUPAC Name: N-(3-cyanophenyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methylamino]acetamide Traditional Name: N-(3-cyanophenyl)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)-methyl-amino]acetamide Formula: C17H14N4O3S MolecularWeight: 354.38306

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC(=C1)C#N)C2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CN(CC(=O)NC1=CC=CC(=C1)C#N)C2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H14N4O3S/c1-21(11-16(22)19-13-6-4-5-12(9-13)10-18)17-14-7-2-3-8-15(14)25(23,24)20-17/h2-9H,11H2,1H3,(H,19,22)