6-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-olate

Systemtic Name: 6-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-olate Openeye Name: 6-[2-(cyclopropylamino)-2-oxo-ethyl]-2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-pyrimidin-4-olate CAS Name: 6-[2-(cyclopropylamino)-2-oxoethyl]-2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 6-[2-(cyclopropylamino)-2-oxoethyl]-2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 6-[2-(cyclopropylamino)-2-keto-ethyl]-2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]pyrimidin-4-olate Formula: C16H17N4O4S- MolecularWeight: 361.39558

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CC2=CC(=NC(=N2)SCC(=O)NCC3=CC=CO3)[O-]

Isomeric SMILES

C1CC1NC(=O)CC2=CC(=NC(=N2)SCC(=O)NCC3=CC=CO3)[O-]

InChI

InChI=1S/C16H18N4O4S/c21-13(18-10-3-4-10)6-11-7-14(22)20-16(19-11)25-9-15(23)17-8-12-2-1-5-24-12/h1-2,5,7,10H,3-4,6,8-9H2,(H,17,23)(H,18,21)(H,19,20,22)/p-1