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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-N-(4-iodanyl-2-methyl-phenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(3,4-dimethoxyphenyl)-N-(4-iodo-2-methyl-phenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(3,4-dimethoxyphenyl)-N-(4-iodo-2-methylphenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(3,4-dimethoxyphenyl)-N-(4-iodo-2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]-(4-iodo-2-methyl-phenyl)amine Formula: C21H18IN3O2S MolecularWeight: 503.35599

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C3C(=CSC3=NC=N2)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C3C(=CSC3=NC=N2)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C21H18IN3O2S/c1-12-8-14(22)5-6-16(12)25-20-19-15(10-28-21(19)24-11-23-20)13-4-7-17(26-2)18(9-13)27-3/h4-11H,1-3H3,(H,23,24,25)