N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(8-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-3-(8-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-3-(4-keto-8-methyl-quinazolin-3-yl)propionamide Formula: C24H23N5O2S MolecularWeight: 445.53672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=CC=C(C=C3)SC4=NC(=CC(=N4)C)C

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=CC=C(C=C3)SC4=NC(=CC(=N4)C)C

InChI

InChI=1S/C24H23N5O2S/c1-15-5-4-6-20-22(15)25-14-29(23(20)31)12-11-21(30)28-18-7-9-19(10-8-18)32-24-26-16(2)13-17(3)27-24/h4-10,13-14H,11-12H2,1-3H3,(H,28,30)