6-azanyl-5-[2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione Openeye Name: 5-[2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanylacetyl]-6-amino-1-isobutyl-3-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-1-oxoethyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione Traditional Name: 5-[2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]acetyl]-6-amino-1-isobutyl-3-methyl-pyrimidine-2,4-quinone Formula: C22H24ClN5O4S MolecularWeight: 489.97506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC=C)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC=C)N

InChI

InChI=1S/C22H24ClN5O4S/c1-5-8-27-19(30)14-7-6-13(23)9-15(14)25-21(27)33-11-16(29)17-18(24)28(10-12(2)3)22(32)26(4)20(17)31/h5-7,9,12H,1,8,10-11,24H2,2-4H3