3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-(phenylcarbamoylamino)phenyl]propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-(phenylcarbamoylamino)phenyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-(phenylcarbamoylamino)phenyl]propanamide CAS Name: N-[3-[[anilino(oxo)methyl]amino]phenyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[3-(phenylcarbamoylamino)phenyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[3-(phenylcarbamoylamino)phenyl]propionamide Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC(=CC=C2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC(=CC=C2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H25N5O2S/c1-15-20(16(2)25-23(24-15)31-3)12-13-21(29)26-18-10-7-11-19(14-18)28-22(30)27-17-8-5-4-6-9-17/h4-11,14H,12-13H2,1-3H3,(H,26,29)(H2,27,28,30)