N-(3-imidazol-1-ylpropyl)-6-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]pyrimidin-4-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-6-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]pyrimidin-4-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-6-[4-(2-isopropylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]pyrimidin-4-amine CAS Name: N-[3-(1-imidazolyl)propyl]-6-[4-[(2-propan-2-ylphenyl)thio]-3-(trifluoromethyl)phenyl]-4-pyrimidinamine IUPAC Name: N-(3-imidazol-1-ylpropyl)-6-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]pyrimidin-4-amine Traditional Name: 3-imidazol-1-ylpropyl-[6-[4-(o-cumenylthio)-3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amine Formula: C26H26F3N5S MolecularWeight: 497.57835

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(C=C(C=C2)C3=CC(=NC=N3)NCCCN4C=CN=C4)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(C=C(C=C2)C3=CC(=NC=N3)NCCCN4C=CN=C4)C(F)(F)F

InChI

InChI=1S/C26H26F3N5S/c1-18(2)20-6-3-4-7-23(20)35-24-9-8-19(14-21(24)26(27,28)29)22-15-25(33-16-32-22)31-10-5-12-34-13-11-30-17-34/h3-4,6-9,11,13-18H,5,10,12H2,1-2H3,(H,31,32,33)