2-(3H-1,3-benzothiazol-2-ylidene)-4-[5,7-bis(bromanyl)quinolin-8-yl]oxy-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[5,7-bis(bromanyl)quinolin-8-yl]oxy-3-oxidanylidene-butanenitrile Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[(5,7-dibromo-8-quinolyl)oxy]-3-oxo-butanenitrile CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[(5,7-dibromo-8-quinolinyl)oxy]-3-oxobutanenitrile IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-(5,7-dibromoquinolin-8-yl)oxy-3-oxobutanenitrile Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[(5,7-dibromo-8-quinolyl)oxy]-3-keto-butyronitrile Formula: C20H11Br2N3O2S MolecularWeight: 517.19324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)COC3=C(C=C(C4=C3N=CC=C4)Br)Br)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)COC3=C(C=C(C4=C3N=CC=C4)Br)Br)S2

InChI

InChI=1S/C20H11Br2N3O2S/c21-13-8-14(22)19(18-11(13)4-3-7-24-18)27-10-16(26)12(9-23)20-25-15-5-1-2-6-17(15)28-20/h1-8,25H,10H2