N-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]-4-pyridin-3-ylcarbonyl-benzamide

Systemtic Name: N-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]-4-pyridin-3-ylcarbonyl-benzamide Openeye Name: N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]-4-(pyridine-3-carbonyl)benzamide CAS Name: N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)thio]ethyl]-4-[oxo(3-pyridinyl)methyl]benzamide IUPAC Name: N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]-4-(pyridine-3-carbonyl)benzamide Traditional Name: N-[2-[(3-keto-4H-1,4-benzothiazin-2-yl)thio]ethyl]-4-nicotinoyl-benzamide Formula: C23H19N3O3S2 MolecularWeight: 449.54526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(S2)SCCNC(=O)C3=CC=C(C=C3)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(S2)SCCNC(=O)C3=CC=C(C=C3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C23H19N3O3S2/c27-20(17-4-3-11-24-14-17)15-7-9-16(10-8-15)21(28)25-12-13-30-23-22(29)26-18-5-1-2-6-19(18)31-23/h1-11,14,23H,12-13H2,(H,25,28)(H,26,29)