5-(4-ethoxyphenyl)-N-(4-iodanyl-2-methyl-phenyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-ethoxyphenyl)-N-(4-iodanyl-2-methyl-phenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-ethoxyphenyl)-N-(4-iodo-2-methyl-phenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-ethoxyphenyl)-N-(4-iodo-2-methylphenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-ethoxyphenyl)-N-(4-iodo-2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: (4-iodo-2-methyl-phenyl)-(5-p-phenetylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C21H18IN3OS MolecularWeight: 487.35659

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C=C4)I)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C=C4)I)C

InChI

InChI=1S/C21H18IN3OS/c1-3-26-16-7-4-14(5-8-16)17-11-27-21-19(17)20(23-12-24-21)25-18-9-6-15(22)10-13(18)2/h4-12H,3H2,1-2H3,(H,23,24,25)