6-[[3-(4-butan-2-ylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-[[3-(4-butan-2-ylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-6-[[4-oxo-3-(4-sec-butylphenyl)quinazolin-2-yl]sulfanylmethyl]pyrimidine-2,4-dione CAS Name: 6-[[[3-(4-butan-2-ylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-[[3-(4-butan-2-ylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-[[[4-keto-3-(4-sec-butylphenyl)quinazolin-2-yl]thio]methyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)N(C(=O)N4C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)N(C(=O)N4C)C

InChI

InChI=1S/C25H26N4O3S/c1-5-16(2)17-10-12-18(13-11-17)29-23(31)20-8-6-7-9-21(20)26-24(29)33-15-19-14-22(30)28(4)25(32)27(19)3/h6-14,16H,5,15H2,1-4H3