2-methylsulfanyl-4-(3-morpholin-4-ylpropylamino)-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-methylsulfanyl-4-(3-morpholin-4-ylpropylamino)-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 2-methylsulfanyl-4-(3-morpholinopropylamino)-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 2-(methylthio)-4-[3-(4-morpholinyl)propylamino]-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 2-methylsulfanyl-4-(3-morpholin-4-ylpropylamino)-6-phenylpyrimidine-5-carbonitrile Traditional Name: 2-(methylthio)-4-(3-morpholinopropylamino)-6-phenyl-pyrimidine-5-carbonitrile Formula: C19H23N5OS MolecularWeight: 369.48382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)NCCCN2CCOCC2)C#N)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=C(C(=N1)NCCCN2CCOCC2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C19H23N5OS/c1-26-19-22-17(15-6-3-2-4-7-15)16(14-20)18(23-19)21-8-5-9-24-10-12-25-13-11-24/h2-4,6-7H,5,8-13H2,1H3,(H,21,22,23)