4-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-butanenitrile Openeye Name: 4-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-butanenitrile CAS Name: 4-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxobutanenitrile IUPAC Name: 4-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxobutanenitrile Traditional Name: 4-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-butyronitrile Formula: C15H11N5O2S2 MolecularWeight: 357.41014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11N5O2S2/c16-6-8(14-18-9-3-1-2-4-11(9)24-14)10(21)7-23-15-19-12(17)5-13(22)20-15/h1-5,18H,7H2,(H3,17,19,20,22)