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

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[5,7-bis(chloranyl)-2-methyl-quinolin-8-yl]oxy-3-oxidanylidene-butanenitrile Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[(5,7-dichloro-2-methyl-8-quinolyl)oxy]-3-oxo-butanenitrile CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[(5,7-dichloro-2-methyl-8-quinolinyl)oxy]-3-oxobutanenitrile IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-(5,7-dichloro-2-methylquinolin-8-yl)oxy-3-oxobutanenitrile Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[(5,7-dichloro-2-methyl-8-quinolyl)oxy]-3-keto-butyronitrile Formula: C21H13Cl2N3O2S MolecularWeight: 442.31782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC(=C2OCC(=O)C(=C3NC4=CC=CC=C4S3)C#N)Cl)Cl

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC(=C2OCC(=O)C(=C3NC4=CC=CC=C4S3)C#N)Cl)Cl

InChI

InChI=1S/C21H13Cl2N3O2S/c1-11-6-7-12-14(22)8-15(23)20(19(12)25-11)28-10-17(27)13(9-24)21-26-16-4-2-3-5-18(16)29-21/h2-8,26H,10H2,1H3