2-[1-[(4-iodophenyl)amino]ethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[1-[(4-iodophenyl)amino]ethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[1-(4-iodoanilino)ethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[1-(4-iodoanilino)ethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[1-(4-iodoanilino)ethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[1-(4-iodoanilino)ethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H16IN3OS MolecularWeight: 425.28721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C(C)NC3=CC=C(C=C3)I)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C(C)NC3=CC=C(C=C3)I)C

InChI

InChI=1S/C16H16IN3OS/c1-8-10(3)22-16-13(8)15(21)19-14(20-16)9(2)18-12-6-4-11(17)5-7-12/h4-7,9,18H,1-3H3,(H,19,20,21)