sodium 3-naphthalen-1-yl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-olate

Systemtic Name: sodium 3-naphthalen-1-yl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-olate Openeye Name: sodium 3-(1-naphthyl)-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-olate CAS Name: sodium 3-(1-naphthalenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-olate IUPAC Name: sodium 3-naphthalen-1-yl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-olate Traditional Name: sodium 4-keto-3-(1-naphthyl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-olate Formula: C20H15N2NaO2S MolecularWeight: 370.40007

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC5=CC=CC=C54)[O-].[Na+]

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC5=CC=CC=C54)[O-].[Na+]

InChI

InChI=1S/C20H16N2O2S.Na/c23-19-17-14-9-3-4-11-16(14)25-18(17)21-20(24)22(19)15-10-5-7-12-6-1-2-8-13(12)15;/h1-2,5-8,10H,3-4,9,11H2,(H,21,24);/q;+1/p-1