6-azanyl-5-[2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-1-isobutyl-3-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylacetyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]acetyl]-1-isobutyl-3-methyl-pyrimidine-2,4-quinone Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)N

InChI

InChI=1S/C22H25N5O4S/c1-12(2)10-26-18(23)17(20(30)25(3)22(26)31)16(28)11-32-21-24-15-7-5-4-6-14(15)19(29)27(21)13-8-9-13/h4-7,12-13H,8-11,23H2,1-3H3