4-oxidanylidene-3-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-pent-2-en-2-olate

Systemtic Name: 4-oxidanylidene-3-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-pent-2-en-2-olate Openeye Name: 4-oxo-3-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-pent-2-en-2-olate CAS Name: 4-oxo-3-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]-2-penten-2-olate IUPAC Name: 4-oxo-3-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpent-2-en-2-olate Traditional Name: 4-keto-3-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]pent-2-en-2-olate Formula: C17H13N2O2S2- MolecularWeight: 341.42732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C)SC1=NC=NC2=C1C=C(S2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CC(=C(C(=O)C)SC1=NC=NC2=C1C=C(S2)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C17H14N2O2S2/c1-10(20)15(11(2)21)23-17-13-8-14(12-6-4-3-5-7-12)22-16(13)18-9-19-17/h3-9,20H,1-2H3/p-1