3-oxidanylidene-N-phenethyl-2-pyrrolidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: 3-oxidanylidene-N-phenethyl-2-pyrrolidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 3-oxo-N-phenethyl-2-pyrrolidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide CAS Name: 3-oxo-N-phenethyl-2-(1-pyrrolidin-1-iumyl)-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 3-oxo-N-phenethyl-2-pyrrolidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-N-phenethyl-2-pyrrolidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Formula: C21H24N3O2S+ MolecularWeight: 382.49916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2S/c25-19(22-11-10-15-6-2-1-3-7-15)16-8-9-18-17(14-16)23-20(26)21(27-18)24-12-4-5-13-24/h1-3,6-9,14,21H,4-5,10-13H2,(H,22,25)(H,23,26)/p+1