N-(2,4-dimethylphenyl)-2-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2,4-dimethylphenyl)-2-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(2,4-dimethylphenyl)-2-[3-(5-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(2,4-dimethylphenyl)-2-[[3-(5-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[3-(5-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(2,4-dimethylphenyl)-2-[[4-keto-3-(5-methyl-2-pyridyl)quinazolin-2-yl]thio]propionamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)C)C

InChI

InChI=1S/C25H24N4O2S/c1-15-9-11-20(17(3)13-15)27-23(30)18(4)32-25-28-21-8-6-5-7-19(21)24(31)29(25)22-12-10-16(2)14-26-22/h5-14,18H,1-4H3,(H,27,30)