2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-N-(6-bromanyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-N-(6-bromanyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(2,5-dioxopyrrol-1-yl)acetamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(2,5-dioxo-1-pyrrolyl)acetamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(2,5-dioxopyrrol-1-yl)acetamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-maleimido-acetamide Formula: C13H8BrN3O3S MolecularWeight: 366.18992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CN3C(=O)C=CC3=O

Isomeric SMILES

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CN3C(=O)C=CC3=O

InChI

InChI=1S/C13H8BrN3O3S/c14-7-1-2-8-9(5-7)21-13(15-8)16-10(18)6-17-11(19)3-4-12(17)20/h1-5H,6H2,(H,15,16,18)