N-[(E)-(3-methylphenyl)methylideneamino]-2-(2-phenylthiomorpholin-4-yl)pyrimidin-4-amine

Systemtic Name: N-[(E)-(3-methylphenyl)methylideneamino]-2-(2-phenylthiomorpholin-4-yl)pyrimidin-4-amine Openeye Name: N-[(E)-m-tolylmethyleneamino]-2-(2-phenylthiomorpholin-4-yl)pyrimidin-4-amine CAS Name: N-[(E)-(3-methylphenyl)methylideneamino]-2-(2-phenyl-4-thiomorpholinyl)-4-pyrimidinamine IUPAC Name: N-[(E)-(3-methylphenyl)methylideneamino]-2-(2-phenylthiomorpholin-4-yl)pyrimidin-4-amine Traditional Name: [(E)-(3-methylbenzylidene)amino]-[2-(2-phenylthiomorpholin-4-yl)pyrimidin-4-yl]amine Formula: C22H23N5S MolecularWeight: 389.51652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=NNC2=NC(=NC=C2)N3CCSC(C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)/C=N/NC2=NC(=NC=C2)N3CCSC(C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5S/c1-17-6-5-7-18(14-17)15-24-26-21-10-11-23-22(25-21)27-12-13-28-20(16-27)19-8-3-2-4-9-19/h2-11,14-15,20H,12-13,16H2,1H3,(H,23,25,26)/b24-15+