7-cyano-4-oxidanylidene-6-[2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl]sulfanyl-1H-thieno[3,2-d]pyrimidin-2-olate

Systemtic Name: 7-cyano-4-oxidanylidene-6-[2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl]sulfanyl-1H-thieno[3,2-d]pyrimidin-2-olate Openeye Name: 7-cyano-4-oxo-6-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]sulfanyl-1H-thieno[3,2-d]pyrimidin-2-olate CAS Name: 7-cyano-4-oxo-6-[[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]thio]-1H-thieno[3,2-d]pyrimidin-2-olate IUPAC Name: 7-cyano-4-oxo-6-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]sulfanyl-1H-thieno[3,2-d]pyrimidin-2-olate Traditional Name: 7-cyano-4-keto-6-[[2-keto-2-[[(1R)-1-phenylethyl]amino]ethyl]thio]-1H-thieno[3,2-d]pyrimidin-2-olate Formula: C17H13N4O3S2- MolecularWeight: 385.44012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CSC2=C(C3=C(S2)C(=O)N=C(N3)[O-])C#N

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)CSC2=C(C3=C(S2)C(=O)N=C(N3)[O-])C#N

InChI

InChI=1S/C17H14N4O3S2/c1-9(10-5-3-2-4-6-10)19-12(22)8-25-16-11(7-18)13-14(26-16)15(23)21-17(24)20-13/h2-6,9H,8H2,1H3,(H,19,22)(H2,20,21,23,24)/p-1/t9-/m1/s1