2-[[5-cyano-6-(furan-2-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[[5-cyano-6-(furan-2-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[[5-cyano-6-(2-furyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[[5-cyano-6-(2-furanyl)-4-oxo-1H-pyrimidin-2-yl]thio]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[[5-cyano-6-(furan-2-yl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[[5-cyano-6-(2-furyl)-4-keto-1H-pyrimidin-2-yl]thio]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C18H10N6O5S2 MolecularWeight: 454.4392

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C(C(=O)N=C(N2)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1=COC(=C1)C2=C(C(=O)N=C(N2)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H10N6O5S2/c19-7-10-15(12-2-1-5-29-12)22-17(23-16(10)26)30-8-14(25)21-18-20-11-4-3-9(24(27)28)6-13(11)31-18/h1-6H,8H2,(H,20,21,25)(H,22,23,26)