N-(3-butylsulfanylpropyl)-2-[(2Z)-3-oxidanylidene-2-(phenylmethylidene)-1,4-benzothiazin-4-yl]ethanamide

Systemtic Name: N-(3-butylsulfanylpropyl)-2-[(2Z)-3-oxidanylidene-2-(phenylmethylidene)-1,4-benzothiazin-4-yl]ethanamide Openeye Name: 2-[(2Z)-2-benzylidene-3-oxo-1,4-benzothiazin-4-yl]-N-(3-butylsulfanylpropyl)acetamide CAS Name: N-[3-(butylthio)propyl]-2-[(2Z)-3-oxo-2-(phenylmethylene)-1,4-benzothiazin-4-yl]acetamide IUPAC Name: 2-[(2Z)-2-benzylidene-3-oxo-1,4-benzothiazin-4-yl]-N-(3-butylsulfanylpropyl)acetamide Traditional Name: 2-[(2Z)-2-benzal-3-keto-1,4-benzothiazin-4-yl]-N-[3-(butylthio)propyl]acetamide Formula: C24H28N2O2S2 MolecularWeight: 440.62132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCNC(=O)CN1C2=CC=CC=C2SC(=CC3=CC=CC=C3)C1=O

Isomeric SMILES

CCCCSCCCNC(=O)CN1C2=CC=CC=C2S/C(=C\C3=CC=CC=C3)/C1=O

InChI

InChI=1S/C24H28N2O2S2/c1-2-3-15-29-16-9-14-25-23(27)18-26-20-12-7-8-13-21(20)30-22(24(26)28)17-19-10-5-4-6-11-19/h4-8,10-13,17H,2-3,9,14-16,18H2,1H3,(H,25,27)/b22-17-