2-morpholin-4-ium-4-yl-6-(4-phenylpiperazin-1-yl)carbonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 2-morpholin-4-ium-4-yl-6-(4-phenylpiperazin-1-yl)carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 2-morpholin-4-ium-4-yl-6-(4-phenylpiperazine-1-carbonyl)-4H-1,4-benzothiazin-3-one CAS Name: 2-(4-morpholin-4-iumyl)-6-[oxo-(4-phenyl-1-piperazinyl)methyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 2-morpholin-4-ium-4-yl-6-(4-phenylpiperazine-1-carbonyl)-4H-1,4-benzothiazin-3-one Traditional Name: 2-morpholin-4-ium-4-yl-6-(4-phenylpiperazine-1-carbonyl)-4H-1,4-benzothiazin-3-one Formula: C23H27N4O3S+ MolecularWeight: 439.55048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C23H26N4O3S/c28-21-23(27-12-14-30-15-13-27)31-20-7-6-17(16-19(20)24-21)22(29)26-10-8-25(9-11-26)18-4-2-1-3-5-18/h1-7,16,23H,8-15H2,(H,24,28)/p+1