[4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-6,7-dimethoxy-1-benzofuran-2-yl]-pyrrol-1-yl-methanone

Systemtic Name: [4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-6,7-dimethoxy-1-benzofuran-2-yl]-pyrrol-1-yl-methanone Openeye Name: [4-[(2,4-diaminopyrimidin-5-yl)methyl]-6,7-dimethoxy-benzofuran-2-yl]-pyrrol-1-yl-methanone CAS Name: [4-[(2,4-diamino-5-pyrimidinyl)methyl]-6,7-dimethoxy-2-benzofuranyl]-(1-pyrrolyl)methanone IUPAC Name: [4-[(2,4-diaminopyrimidin-5-yl)methyl]-6,7-dimethoxy-1-benzofuran-2-yl]-pyrrol-1-ylmethanone Traditional Name: [4-[(2,4-diaminopyrimidin-5-yl)methyl]-6,7-dimethoxy-benzofuran-2-yl]-pyrrol-1-yl-methanone Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C(O2)C(=O)N3C=CC=C3)C(=C1)CC4=CN=C(N=C4N)N)OC

Isomeric SMILES

COC1=C(C2=C(C=C(O2)C(=O)N3C=CC=C3)C(=C1)CC4=CN=C(N=C4N)N)OC

InChI

InChI=1S/C20H19N5O4/c1-27-14-8-11(7-12-10-23-20(22)24-18(12)21)13-9-15(29-16(13)17(14)28-2)19(26)25-5-3-4-6-25/h3-6,8-10H,7H2,1-2H3,(H4,21,22,23,24)