N-(2,3-dimethylcyclohexyl)-2-morpholin-4-ium-4-yl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-2-morpholin-4-ium-4-yl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-(2,3-dimethylcyclohexyl)-2-morpholin-4-ium-4-yl-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-(2,3-dimethylcyclohexyl)-2-(4-morpholin-4-iumyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-2-morpholin-4-ium-4-yl-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-(2,3-dimethylcyclohexyl)-3-keto-2-morpholin-4-ium-4-yl-4H-1,4-benzothiazine-6-carboxamide Formula: C21H30N3O3S+ MolecularWeight: 404.5462

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=CC3=C(C=C2)SC(C(=O)N3)[NH+]4CCOCC4

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2=CC3=C(C=C2)SC(C(=O)N3)[NH+]4CCOCC4

InChI

InChI=1S/C21H29N3O3S/c1-13-4-3-5-16(14(13)2)22-19(25)15-6-7-18-17(12-15)23-20(26)21(28-18)24-8-10-27-11-9-24/h6-7,12-14,16,21H,3-5,8-11H2,1-2H3,(H,22,25)(H,23,26)/p+1