6-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-N,2-dimethyl-N-(phenylmethyl)pyrimidin-4-amine

Systemtic Name: 6-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-N,2-dimethyl-N-(phenylmethyl)pyrimidin-4-amine Openeye Name: 6-[5-(benzothiophen-2-yl)-3-pyridyl]-N-benzyl-N,2-dimethyl-pyrimidin-4-amine CAS Name: 6-[5-(1-benzothiophen-2-yl)-3-pyridinyl]-N,2-dimethyl-N-(phenylmethyl)-4-pyrimidinamine IUPAC Name: 6-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-N-benzyl-N,2-dimethylpyrimidin-4-amine Traditional Name: [6-[5-(benzothiophen-2-yl)-3-pyridyl]-2-methyl-pyrimidin-4-yl]-benzyl-methyl-amine Formula: C26H22N4S MolecularWeight: 422.54468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N(C)CC2=CC=CC=C2)C3=CC(=CN=C3)C4=CC5=CC=CC=C5S4

Isomeric SMILES

CC1=NC(=CC(=N1)N(C)CC2=CC=CC=C2)C3=CC(=CN=C3)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C26H22N4S/c1-18-28-23(14-26(29-18)30(2)17-19-8-4-3-5-9-19)21-12-22(16-27-15-21)25-13-20-10-6-7-11-24(20)31-25/h3-16H,17H2,1-2H3