(2Z)-N-[1-(4-butoxyphenyl)ethyl]-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)ethanamide

Systemtic Name: (2Z)-N-[1-(4-butoxyphenyl)ethyl]-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)ethanamide Openeye Name: (2Z)-N-[1-(4-butoxyphenyl)ethyl]-2-(3-oxo-4H-1,4-benzothiazin-2-ylidene)acetamide CAS Name: (2Z)-N-[1-(4-butoxyphenyl)ethyl]-2-(3-oxo-4H-1,4-benzothiazin-2-ylidene)acetamide IUPAC Name: (2Z)-N-[1-(4-butoxyphenyl)ethyl]-2-(3-oxo-4H-1,4-benzothiazin-2-ylidene)acetamide Traditional Name: (2Z)-N-[1-(4-butoxyphenyl)ethyl]-2-(3-keto-4H-1,4-benzothiazin-2-ylidene)acetamide Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(C)NC(=O)C=C2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(C)NC(=O)/C=C\2/C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C22H24N2O3S/c1-3-4-13-27-17-11-9-16(10-12-17)15(2)23-21(25)14-20-22(26)24-18-7-5-6-8-19(18)28-20/h5-12,14-15H,3-4,13H2,1-2H3,(H,23,25)(H,24,26)/b20-14-