5-(4-propan-2-ylphenyl)-N-[4-(pyridin-4-ylmethyl)phenyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-propan-2-ylphenyl)-N-[4-(pyridin-4-ylmethyl)phenyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-isopropylphenyl)-N-[4-(4-pyridylmethyl)phenyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-propan-2-ylphenyl)-N-[4-(pyridin-4-ylmethyl)phenyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-propan-2-ylphenyl)-N-[4-(pyridin-4-ylmethyl)phenyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: (5-p-cumenylthieno[2,3-d]pyrimidin-4-yl)-[4-(4-pyridylmethyl)phenyl]amine Formula: C27H24N4S MolecularWeight: 436.57126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC=C(C=C4)CC5=CC=NC=C5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC=C(C=C4)CC5=CC=NC=C5

InChI

InChI=1S/C27H24N4S/c1-18(2)21-5-7-22(8-6-21)24-16-32-27-25(24)26(29-17-30-27)31-23-9-3-19(4-10-23)15-20-11-13-28-14-12-20/h3-14,16-18H,15H2,1-2H3,(H,29,30,31)