6-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-2-methyl-N-phenethyl-pyrimidin-4-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NCCC2=CC=CC=C2)C3=CC(=CN=C3)C4=CC5=CC=CC=C5S4

Isomeric SMILES

CC1=NC(=CC(=N1)NCCC2=CC=CC=C2)C3=CC(=CN=C3)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C26H22N4S/c1-18-29-23(15-26(30-18)28-12-11-19-7-3-2-4-8-19)21-13-22(17-27-16-21)25-14-20-9-5-6-10-24(20)31-25/h2-10,13-17H,11-12H2,1H3,(H,28,29,30)