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

Systemtic Name: 6-bromanyl-5-[[(2,5-dimethoxyphenyl)-methyl-amino]methyl]thieno[2,3-d]pyrimidine-2,4-diamine Openeye Name: 6-bromo-5-[(2,5-dimethoxy-N-methyl-anilino)methyl]thieno[2,3-d]pyrimidine-2,4-diamine CAS Name: 6-bromo-5-[(2,5-dimethoxy-N-methylanilino)methyl]thieno[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 6-bromo-5-[(2,5-dimethoxy-N-methylanilino)methyl]thieno[2,3-d]pyrimidine-2,4-diamine Traditional Name: (2,4-diamino-6-bromo-thieno[2,3-d]pyrimidin-5-yl)methyl-(2,5-dimethoxyphenyl)-methyl-amine Formula: C16H18BrN5O2S MolecularWeight: 424.31542

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(SC2=NC(=NC(=C12)N)N)Br)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CN(CC1=C(SC2=NC(=NC(=C12)N)N)Br)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C16H18BrN5O2S/c1-22(10-6-8(23-2)4-5-11(10)24-3)7-9-12-14(18)20-16(19)21-15(12)25-13(9)17/h4-6H,7H2,1-3H3,(H4,18,19,20,21)