N-[4-(3,4-dimethylphenyl)sulfanylphenyl]-3-(6-methyl-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-[4-(3,4-dimethylphenyl)sulfanylphenyl]-3-(6-methyl-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[4-(3,4-dimethylphenyl)sulfanylphenyl]-3-(6-methyl-2-morpholino-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[4-[(3,4-dimethylphenyl)thio]phenyl]-3-[6-methyl-2-(4-morpholinyl)-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-[4-(3,4-dimethylphenyl)sulfanylphenyl]-3-(6-methyl-2-morpholin-4-yl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-[4-[(3,4-dimethylphenyl)thio]phenyl]-3-(4-keto-6-methyl-2-morpholino-1H-pyrimidin-5-yl)propionamide Formula: C26H30N4O3S MolecularWeight: 478.6064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=CC=C(C=C2)NC(=O)CCC3=C(NC(=NC3=O)N4CCOCC4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=CC=C(C=C2)NC(=O)CCC3=C(NC(=NC3=O)N4CCOCC4)C)C

InChI

InChI=1S/C26H30N4O3S/c1-17-4-7-22(16-18(17)2)34-21-8-5-20(6-9-21)28-24(31)11-10-23-19(3)27-26(29-25(23)32)30-12-14-33-15-13-30/h4-9,16H,10-15H2,1-3H3,(H,28,31)(H,27,29,32)