2-methyl-4-nonoxy-1,1-bis(oxidanylidene)-N-pyridin-2-yl-1$l^{6},2-benzothiazine-3-carboxamide

Systemtic Name: 2-methyl-4-nonoxy-1,1-bis(oxidanylidene)-N-pyridin-2-yl-1$l^{6},2-benzothiazine-3-carboxamide Openeye Name: 2-methyl-4-nonoxy-1,1-dioxo-N-(2-pyridyl)-1$l^{6},2-benzothiazine-3-carboxamide CAS Name: 2-methyl-4-nonoxy-1,1-dioxo-N-(2-pyridinyl)-1$l^{6},2-benzothiazine-3-carboxamide IUPAC Name: 2-methyl-4-nonoxy-1,1-dioxo-N-pyridin-2-yl-1$l^{6},2-benzothiazine-3-carboxamide Traditional Name: 1,1-diketo-2-methyl-4-nonoxy-N-(2-pyridyl)-1$l^{6},2-benzothiazine-3-carboxamide Formula: C24H31N3O4S MolecularWeight: 457.58564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=C(N(S(=O)(=O)C2=CC=CC=C21)C)C(=O)NC3=CC=CC=N3

Isomeric SMILES

CCCCCCCCCOC1=C(N(S(=O)(=O)C2=CC=CC=C21)C)C(=O)NC3=CC=CC=N3

InChI

InChI=1S/C24H31N3O4S/c1-3-4-5-6-7-8-13-18-31-23-19-14-9-10-15-20(19)32(29,30)27(2)22(23)24(28)26-21-16-11-12-17-25-21/h9-12,14-17H,3-8,13,18H2,1-2H3,(H,25,26,28)