[(3R)-3-cyano-4-oxidanylidene-5-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-pent-1-en-2-yl]azanium

Systemtic Name: [(3R)-3-cyano-4-oxidanylidene-5-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-pent-1-en-2-yl]azanium Openeye Name: [(2R)-2-cyano-1-methylene-3-oxo-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-butyl]ammonium CAS Name: [(3R)-3-cyano-4-oxo-5-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)oxy]pent-1-en-2-yl]ammonium IUPAC Name: [(3R)-3-cyano-4-oxo-5-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxypent-1-en-2-yl]azanium Traditional Name: 1-[(1R)-1-cyano-2-keto-3-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-propyl]vinylammonium Formula: C18H15N4O2S+ MolecularWeight: 351.4023

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(C#N)C(=O)COC1=C2C(=CSC2=NC=N1)C3=CC=CC=C3)[NH3+]

Isomeric SMILES

C=C([C@H](C#N)C(=O)COC1=C2C(=CSC2=NC=N1)C3=CC=CC=C3)[NH3+]

InChI

InChI=1S/C18H14N4O2S/c1-11(20)13(7-19)15(23)8-24-17-16-14(12-5-3-2-4-6-12)9-25-18(16)22-10-21-17/h2-6,9-10,13H,1,8,20H2/p+1/t13-/m0/s1