6-azanyl-5-[2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[7-chloro-4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanylacetyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[[7-chloro-4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]-1-oxoethyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[7-chloro-4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylacetyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[[7-chloro-4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]acetyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C21H22ClN5O5S MolecularWeight: 491.94788

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4)N

InChI

InChI=1S/C21H22ClN5O5S/c1-25-17(23)16(19(30)26(2)21(25)31)15(28)10-33-20-24-14-8-11(22)5-6-13(14)18(29)27(20)9-12-4-3-7-32-12/h5-6,8,12H,3-4,7,9-10,23H2,1-2H3