sodium 3-(3-methoxyphenyl)-2,6-bis(oxidanylidene)-5-(thiophen-2-ylmethyl)pyrimidin-4-olate

Systemtic Name: sodium 3-(3-methoxyphenyl)-2,6-bis(oxidanylidene)-5-(thiophen-2-ylmethyl)pyrimidin-4-olate Openeye Name: sodium 3-(3-methoxyphenyl)-2,6-dioxo-5-(2-thienylmethyl)pyrimidin-4-olate CAS Name: sodium 3-(3-methoxyphenyl)-2,6-dioxo-5-(thiophen-2-ylmethyl)-4-pyrimidinolate IUPAC Name: sodium 3-(3-methoxyphenyl)-2,6-dioxo-5-(thiophen-2-ylmethyl)pyrimidin-4-olate Traditional Name: sodium 2,6-diketo-3-(3-methoxyphenyl)-5-(2-thenyl)pyrimidin-4-olate Formula: C16H13N2NaO4S MolecularWeight: 352.34019

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=C(C(=O)NC2=O)CC3=CC=CS3)[O-].[Na+]

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=C(C(=O)NC2=O)CC3=CC=CS3)[O-].[Na+]

InChI

InChI=1S/C16H14N2O4S.Na/c1-22-11-5-2-4-10(8-11)18-15(20)13(14(19)17-16(18)21)9-12-6-3-7-23-12;/h2-8,20H,9H2,1H3,(H,17,19,21);/q;+1/p-1