6-azanyl-1,3-dimethyl-5-[2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylpropanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1,3-dimethyl-5-[2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylpropanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanoyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]propanoyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C20H23N5O5S MolecularWeight: 445.49212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=C(N(C(=O)N(C1=O)C)C)N)SC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CC(C(=O)C1=C(N(C(=O)N(C1=O)C)C)N)SC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C20H23N5O5S/c1-11(15(27)14-16(21)23(2)20(30)24(3)18(14)29)31-19-22-13-8-5-4-7-12(13)17(28)25(19)9-6-10-26/h4-5,7-8,11,26H,6,9-10,21H2,1-3H3