(2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-4-pyrimidin-2-ylsulfanyl-butanenitrile

Systemtic Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-4-pyrimidin-2-ylsulfanyl-butanenitrile Openeye Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-pyrimidin-2-ylsulfanyl-butanenitrile CAS Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-(2-pyrimidinylthio)butanenitrile IUPAC Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-pyrimidin-2-ylsulfanylbutanenitrile Traditional Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-4-(2-pyrimidylthio)butyronitrile Formula: C15H10N4OS2 MolecularWeight: 326.3961

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CSC3=NC=CC=N3)S2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C(\C#N)/C(=O)CSC3=NC=CC=N3)/S2

InChI

InChI=1S/C15H10N4OS2/c16-8-10(12(20)9-21-15-17-6-3-7-18-15)14-19-11-4-1-2-5-13(11)22-14/h1-7,19H,9H2/b14-10-