2-[(4-chlorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-6-(4-methylphenyl)pyrimidin-4-amine

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-6-(4-methylphenyl)pyrimidin-4-amine Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-(2-furylmethyl)-6-(p-tolyl)pyrimidin-4-amine CAS Name: 2-[(4-chlorophenyl)methylthio]-N-(2-furanylmethyl)-6-(4-methylphenyl)-4-pyrimidinamine IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-6-(4-methylphenyl)pyrimidin-4-amine Traditional Name: [2-[(4-chlorobenzyl)thio]-6-(p-tolyl)pyrimidin-4-yl]-(2-furfuryl)amine Formula: C23H20ClN3OS MolecularWeight: 421.9424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)Cl)NCC4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)Cl)NCC4=CC=CO4

InChI

InChI=1S/C23H20ClN3OS/c1-16-4-8-18(9-5-16)21-13-22(25-14-20-3-2-12-28-20)27-23(26-21)29-15-17-6-10-19(24)11-7-17/h2-13H,14-15H2,1H3,(H,25,26,27)