6-[[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-[[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-[(7-chloro-3-isopentyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-[[[7-chloro-3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]methyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-[[7-chloro-3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-[[(7-chloro-3-isoamyl-4-keto-quinazolin-2-yl)thio]methyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C20H23ClN4O3S MolecularWeight: 434.93962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=O)N(C(=O)N3C)C

InChI

InChI=1S/C20H23ClN4O3S/c1-12(2)7-8-25-18(27)15-6-5-13(21)9-16(15)22-19(25)29-11-14-10-17(26)24(4)20(28)23(14)3/h5-6,9-10,12H,7-8,11H2,1-4H3