3-azanylidene-2-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1,3-thiazol-4-yl]butanenitrile

Systemtic Name: 3-azanylidene-2-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1,3-thiazol-4-yl]butanenitrile Openeye Name: 2-[2-(3-chloro-4-fluoro-anilino)thiazol-4-yl]-3-imino-butanenitrile CAS Name: 2-[2-(3-chloro-4-fluoroanilino)-4-thiazolyl]-3-iminobutanenitrile IUPAC Name: 2-[2-(3-chloro-4-fluoroanilino)-1,3-thiazol-4-yl]-3-iminobutanenitrile Traditional Name: 2-[2-(3-chloro-4-fluoro-anilino)thiazol-4-yl]-3-imino-butyronitrile Formula: C13H10ClFN4S MolecularWeight: 308.761703

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C1=CSC(=N1)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC(=N)C(C#N)C1=CSC(=N1)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H10ClFN4S/c1-7(17)9(5-16)12-6-20-13(19-12)18-8-2-3-11(15)10(14)4-8/h2-4,6,9,17H,1H3,(H,18,19)