3-cyclopentyl-2-[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 3-cyclopentyl-2-[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 3-cyclopentyl-2-[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]sulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-cyclopentyl-2-[[2-(1-ethyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethyl]thio]-6-oxo-4-pyrimidinolate IUPAC Name: 3-cyclopentyl-2-[2-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]sulfanyl-6-oxopyrimidin-4-olate Traditional Name: 3-cyclopentyl-2-[[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]thio]-6-keto-pyrimidin-4-olate Formula: C19H24N3O3S- MolecularWeight: 374.47716

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)CSC2=NC(=O)C=C(N2C3CCCC3)[O-])C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)CSC2=NC(=O)C=C(N2C3CCCC3)[O-])C

InChI

InChI=1S/C19H25N3O3S/c1-4-21-12(2)9-15(13(21)3)16(23)11-26-19-20-17(24)10-18(25)22(19)14-7-5-6-8-14/h9-10,14,25H,4-8,11H2,1-3H3/p-1