7-ethoxy-2-[1-(2-methylpropyl)-2-oxidanylidene-indol-3-ylidene]-4H-1,4-benzothiazin-3-one

Systemtic Name: 7-ethoxy-2-[1-(2-methylpropyl)-2-oxidanylidene-indol-3-ylidene]-4H-1,4-benzothiazin-3-one Openeye Name: 7-ethoxy-2-(1-isobutyl-2-oxo-indolin-3-ylidene)-4H-1,4-benzothiazin-3-one CAS Name: 7-ethoxy-2-[1-(2-methylpropyl)-2-oxo-3-indolylidene]-4H-1,4-benzothiazin-3-one IUPAC Name: 7-ethoxy-2-[1-(2-methylpropyl)-2-oxoindol-3-ylidene]-4H-1,4-benzothiazin-3-one Traditional Name: 7-ethoxy-2-(1-isobutyl-2-keto-indolin-3-ylidene)-4H-1,4-benzothiazin-3-one Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C3C4=CC=CC=C4N(C3=O)CC(C)C)S2

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C3C4=CC=CC=C4N(C3=O)CC(C)C)S2

InChI

InChI=1S/C22H22N2O3S/c1-4-27-14-9-10-16-18(11-14)28-20(21(25)23-16)19-15-7-5-6-8-17(15)24(22(19)26)12-13(2)3/h5-11,13H,4,12H2,1-3H3,(H,23,25)