4-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile Openeye Name: 4-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxo-butanenitrile CAS Name: 4-[(5-chloro-1,3-benzoxazol-2-yl)thio]-2-(1,3-dimethyl-2-benzimidazolylidene)-3-oxobutanenitrile IUPAC Name: 4-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxobutanenitrile Traditional Name: 4-[(5-chloro-1,3-benzoxazol-2-yl)thio]-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-butyronitrile Formula: C20H15ClN4O2S MolecularWeight: 410.8767

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=NC4=C(O3)C=CC(=C4)Cl)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=NC4=C(O3)C=CC(=C4)Cl)C

InChI

InChI=1S/C20H15ClN4O2S/c1-24-15-5-3-4-6-16(15)25(2)19(24)13(10-22)17(26)11-28-20-23-14-9-12(21)7-8-18(14)27-20/h3-9H,11H2,1-2H3