3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-ethyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]propionamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CCC3=C(N=C(N=C3C)SC)C

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CCC3=C(N=C(N=C3C)SC)C

InChI

InChI=1S/C21H25N5O2S/c1-5-26(12-18-24-17-9-7-6-8-16(17)20(28)25-18)19(27)11-10-15-13(2)22-21(29-4)23-14(15)3/h6-9H,5,10-12H2,1-4H3,(H,24,25,28)