5-[[2-(dimethylaminomethyl)-6,7-dimethoxy-1-benzofuran-4-yl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[2-(dimethylaminomethyl)-6,7-dimethoxy-1-benzofuran-4-yl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[2-(dimethylaminomethyl)-6,7-dimethoxy-benzofuran-4-yl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[2-(dimethylaminomethyl)-6,7-dimethoxy-4-benzofuranyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[2-(dimethylaminomethyl)-6,7-dimethoxy-1-benzofuran-4-yl]methyl]pyrimidine-2,4-diamine Traditional Name: [4-[(2,4-diaminopyrimidin-5-yl)methyl]-6,7-dimethoxy-benzofuran-2-yl]methyl-dimethyl-amine Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC2=C(O1)C(=C(C=C2CC3=CN=C(N=C3N)N)OC)OC

Isomeric SMILES

CN(C)CC1=CC2=C(O1)C(=C(C=C2CC3=CN=C(N=C3N)N)OC)OC

InChI

InChI=1S/C18H23N5O3/c1-23(2)9-12-7-13-10(5-11-8-21-18(20)22-17(11)19)6-14(24-3)16(25-4)15(13)26-12/h6-8H,5,9H2,1-4H3,(H4,19,20,21,22)