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

Systemtic Name: 5-(3,4-dimethylphenyl)-N-(4-iodanyl-2-methyl-phenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(3,4-dimethylphenyl)-N-(4-iodo-2-methyl-phenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(3,4-dimethylphenyl)-N-(4-iodo-2-methylphenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(3,4-dimethylphenyl)-N-(4-iodo-2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4-yl]-(4-iodo-2-methyl-phenyl)amine Formula: C21H18IN3S MolecularWeight: 471.35719

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C=C4)I)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C=C4)I)C)C

InChI

InChI=1S/C21H18IN3S/c1-12-4-5-15(8-13(12)2)17-10-26-21-19(17)20(23-11-24-21)25-18-7-6-16(22)9-14(18)3/h4-11H,1-3H3,(H,23,24,25)