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

Systemtic Name: 2,6-bis(oxidanylidene)-3-phenethyl-5-(thiophen-2-ylmethyl)pyrimidin-4-olate Openeye Name: 2,6-dioxo-3-phenethyl-5-(2-thienylmethyl)pyrimidin-4-olate CAS Name: 2,6-dioxo-3-phenethyl-5-(thiophen-2-ylmethyl)-4-pyrimidinolate IUPAC Name: 2,6-dioxo-3-phenethyl-5-(thiophen-2-ylmethyl)pyrimidin-4-olate Traditional Name: 2,6-diketo-3-phenethyl-5-(2-thenyl)pyrimidin-4-olate Formula: C17H15N2O3S- MolecularWeight: 327.3776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=C(C(=O)NC2=O)CC3=CC=CS3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=C(C(=O)NC2=O)CC3=CC=CS3)[O-]

InChI

InChI=1S/C17H16N2O3S/c20-15-14(11-13-7-4-10-23-13)16(21)19(17(22)18-15)9-8-12-5-2-1-3-6-12/h1-7,10,21H,8-9,11H2,(H,18,20,22)/p-1