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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=C3C(=O)NC4=C(S3)C=C(C=C4)OCC)C1=O

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=C3C(=O)NC4=C(S3)C=C(C=C4)OCC)C1=O

InChI

InChI=1S/C22H22N2O3S/c1-3-5-12-24-17-9-7-6-8-15(17)19(22(24)26)20-21(25)23-16-11-10-14(27-4-2)13-18(16)28-20/h6-11,13H,3-5,12H2,1-2H3,(H,23,25)