4-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile

Systemtic Name: 4-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Openeye Name: 4-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-3-oxo-2-(4-phenylthiazol-2-yl)butanenitrile CAS Name: 4-[(5-chloro-1,3-benzothiazol-2-yl)thio]-3-oxo-2-(4-phenyl-2-thiazolyl)butanenitrile IUPAC Name: 4-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Traditional Name: 4-[(5-chloro-1,3-benzothiazol-2-yl)thio]-3-keto-2-(4-phenylthiazol-2-yl)butyronitrile Formula: C20H12ClN3OS3 MolecularWeight: 441.97678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)CSC3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)CSC3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C20H12ClN3OS3/c21-13-6-7-18-15(8-13)24-20(28-18)27-11-17(25)14(9-22)19-23-16(10-26-19)12-4-2-1-3-5-12/h1-8,10,14H,11H2