3H-1,3-benzothiazol-2-ylidene-(4-oxidanyl-2-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazol-3-yl)carbonyl-azanium

Systemtic Name: 3H-1,3-benzothiazol-2-ylidene-(4-oxidanyl-2-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazol-3-yl)carbonyl-azanium Openeye Name: 3H-1,3-benzothiazol-2-ylidene-(4-hydroxy-2-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-carbonyl)ammonium CAS Name: 3H-1,3-benzothiazol-2-ylidene-[(4-hydroxy-2-oxo-3-pyrimido[2,1-b][1,3]benzothiazolyl)-oxomethyl]ammonium IUPAC Name: 3H-1,3-benzothiazol-2-ylidene-(4-hydroxy-2-oxopyrimido[2,1-b][1,3]benzothiazole-3-carbonyl)azanium Traditional Name: 3H-1,3-benzothiazol-2-ylidene-(4-hydroxy-2-keto-pyrimido[2,1-b][1,3]benzothiazole-3-carbonyl)ammonium Formula: C18H11N4O3S2+ MolecularWeight: 395.43494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[NH+]C(=O)C3=C(N4C5=CC=CC=C5SC4=NC3=O)O)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[NH+]C(=O)C3=C(N4C5=CC=CC=C5SC4=NC3=O)O)S2

InChI

InChI=1S/C18H10N4O3S2/c23-14(20-17-19-9-5-1-3-7-11(9)26-17)13-15(24)21-18-22(16(13)25)10-6-2-4-8-12(10)27-18/h1-8,25H,(H,19,20,23)/p+1