1,3-bis[10-(methoxymethyl)pyrazino[2,3-b][1,4]benzothiazin-8-yl]propan-2-one

Systemtic Name: 1,3-bis[10-(methoxymethyl)pyrazino[2,3-b][1,4]benzothiazin-8-yl]propan-2-one Openeye Name: 1,3-bis[10-(methoxymethyl)pyrazino[2,3-b][1,4]benzothiazin-8-yl]propan-2-one CAS Name: 1,3-bis[10-(methoxymethyl)-8-pyrazino[2,3-b][1,4]benzothiazinyl]-2-propanone IUPAC Name: 1,3-bis[10-(methoxymethyl)pyrazino[2,3-b][1,4]benzothiazin-8-yl]propan-2-one Traditional Name: 1,3-bis[10-(methoxymethyl)pyrazino[2,3-b][1,4]benzothiazin-8-yl]acetone Formula: C27H24N6O3S2 MolecularWeight: 544.64786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCN1C2=C(C=CC(=C2)CC(=O)CC3=CC4=C(C=C3)SC5=NC=CN=C5N4COC)SC6=NC=CN=C61

Isomeric SMILES

COCN1C2=C(C=CC(=C2)CC(=O)CC3=CC4=C(C=C3)SC5=NC=CN=C5N4COC)SC6=NC=CN=C61

InChI

InChI=1S/C27H24N6O3S2/c1-35-15-32-20-13-17(3-5-22(20)37-26-24(32)28-7-9-30-26)11-19(34)12-18-4-6-23-21(14-18)33(16-36-2)25-27(38-23)31-10-8-29-25/h3-10,13-14H,11-12,15-16H2,1-2H3