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

Systemtic Name: 6-azanyl-5-[2-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[3-(2,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[[3-(2,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[[3-(2,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]propanoyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C25H25N5O4S MolecularWeight: 491.5621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)C4=C(N(C(=O)N(C4=O)C)C)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)C4=C(N(C(=O)N(C4=O)C)C)N

InChI

InChI=1S/C25H25N5O4S/c1-13-10-11-14(2)18(12-13)30-22(32)16-8-6-7-9-17(16)27-24(30)35-15(3)20(31)19-21(26)28(4)25(34)29(5)23(19)33/h6-12,15H,26H2,1-5H3