3-cyclopentyl-6-oxidanylidene-2-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]sulfanyl-pyrimidin-4-olate

Systemtic Name: 3-cyclopentyl-6-oxidanylidene-2-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]sulfanyl-pyrimidin-4-olate Openeye Name: 3-cyclopentyl-6-oxo-2-[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]sulfanyl-pyrimidin-4-olate CAS Name: 3-cyclopentyl-6-oxo-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]thio]-4-pyrimidinolate IUPAC Name: 3-cyclopentyl-6-oxo-2-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]sulfanylpyrimidin-4-olate Traditional Name: 3-cyclopentyl-6-keto-2-[[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]thio]pyrimidin-4-olate Formula: C17H20N3O3S2- MolecularWeight: 378.489

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC(=O)N=C2SCC(=O)NCCC3=CC=CS3)[O-]

Isomeric SMILES

C1CCC(C1)N2C(=CC(=O)N=C2SCC(=O)NCCC3=CC=CS3)[O-]

InChI

InChI=1S/C17H21N3O3S2/c21-14-10-16(23)20(12-4-1-2-5-12)17(19-14)25-11-15(22)18-8-7-13-6-3-9-24-13/h3,6,9-10,12,23H,1-2,4-5,7-8,11H2,(H,18,22)/p-1