6-[(4-chlorophenyl)sulfanylmethyl]-N-(phenylmethyl)-2-pyridin-3-yl-pyrimidin-4-amine

Systemtic Name: 6-[(4-chlorophenyl)sulfanylmethyl]-N-(phenylmethyl)-2-pyridin-3-yl-pyrimidin-4-amine Openeye Name: N-benzyl-6-[(4-chlorophenyl)sulfanylmethyl]-2-(3-pyridyl)pyrimidin-4-amine CAS Name: 6-[[(4-chlorophenyl)thio]methyl]-N-(phenylmethyl)-2-(3-pyridinyl)-4-pyrimidinamine IUPAC Name: N-benzyl-6-[(4-chlorophenyl)sulfanylmethyl]-2-pyridin-3-ylpyrimidin-4-amine Traditional Name: benzyl-[6-[[(4-chlorophenyl)thio]methyl]-2-(3-pyridyl)pyrimidin-4-yl]amine Formula: C23H19ClN4S MolecularWeight: 418.94176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC(=C2)CSC3=CC=C(C=C3)Cl)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC(=C2)CSC3=CC=C(C=C3)Cl)C4=CN=CC=C4

InChI

InChI=1S/C23H19ClN4S/c24-19-8-10-21(11-9-19)29-16-20-13-22(26-14-17-5-2-1-3-6-17)28-23(27-20)18-7-4-12-25-15-18/h1-13,15H,14,16H2,(H,26,27,28)