6-[(2-bromanyl-3,4,5-trimethoxy-phenyl)methyl]-5-methyl-thieno[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: 6-[(2-bromanyl-3,4,5-trimethoxy-phenyl)methyl]-5-methyl-thieno[2,3-d]pyrimidine-2,4-diamine Openeye Name: 6-[(2-bromo-3,4,5-trimethoxy-phenyl)methyl]-5-methyl-thieno[2,3-d]pyrimidine-2,4-diamine CAS Name: 6-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 6-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-2,4-diamine Traditional Name: [2-amino-6-(2-bromo-3,4,5-trimethoxy-benzyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amine Formula: C17H19BrN4O3S MolecularWeight: 439.32676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)N)CC3=CC(=C(C(=C3Br)OC)OC)OC

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)N)CC3=CC(=C(C(=C3Br)OC)OC)OC

InChI

InChI=1S/C17H19BrN4O3S/c1-7-10(26-16-11(7)15(19)21-17(20)22-16)6-8-5-9(23-2)13(24-3)14(25-4)12(8)18/h5H,6H2,1-4H3,(H4,19,20,21,22)