2-[[2-[(3-methoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]ethyl-bis(2-methylpropyl)azanium

Systemtic Name: 2-[[2-[(3-methoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]ethyl-bis(2-methylpropyl)azanium Openeye Name: diisobutyl-[2-[[2-[(3-methoxyphenyl)methylene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]ethyl]ammonium CAS Name: 2-[[[2-[(3-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazin-6-yl]-oxomethyl]amino]ethyl-bis(2-methylpropyl)ammonium IUPAC Name: 2-[[2-[(3-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]ethyl-bis(2-methylpropyl)azanium Traditional Name: diisobutyl-[2-[(3-keto-2-m-anisylidene-4H-1,4-benzothiazine-6-carbonyl)amino]ethyl]ammonium Formula: C27H36N3O3S+ MolecularWeight: 482.65804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CCNC(=O)C1=CC2=C(C=C1)SC(=CC3=CC(=CC=C3)OC)C(=O)N2)CC(C)C

Isomeric SMILES

CC(C)C[NH+](CCNC(=O)C1=CC2=C(C=C1)SC(=CC3=CC(=CC=C3)OC)C(=O)N2)CC(C)C

InChI

InChI=1S/C27H35N3O3S/c1-18(2)16-30(17-19(3)4)12-11-28-26(31)21-9-10-24-23(15-21)29-27(32)25(34-24)14-20-7-6-8-22(13-20)33-5/h6-10,13-15,18-19H,11-12,16-17H2,1-5H3,(H,28,31)(H,29,32)/p+1