N-(1-adamantylmethyl)-5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(1-adamantylmethyl)-5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1-adamantylmethyl)-5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1-adamantylmethyl)-5-phenyl-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1-adamantylmethyl)-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: 1-adamantylmethyl-[5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C28H28N4S MolecularWeight: 452.61372

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC4=C5C(=CSC5=NC(=N4)C6=CN=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC4=C5C(=CSC5=NC(=N4)C6=CN=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C28H28N4S/c1-2-5-21(6-3-1)23-16-33-27-24(23)26(31-25(32-27)22-7-4-8-29-15-22)30-17-28-12-18-9-19(13-28)11-20(10-18)14-28/h1-8,15-16,18-20H,9-14,17H2,(H,30,31,32)