2-[[1,3-benzoxazol-2-ylmethyl(ethyl)amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[[1,3-benzoxazol-2-ylmethyl(ethyl)amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[[1,3-benzoxazol-2-ylmethyl(ethyl)amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[1,3-benzoxazol-2-ylmethyl(ethyl)amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[[1,3-benzoxazol-2-ylmethyl(ethyl)amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[1,3-benzoxazol-2-ylmethyl(ethyl)amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)CC3=NC4=CC=CC=C4O3

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)CC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H22N4O4/c1-4-25(12-20-23-14-7-5-6-8-16(14)29-20)11-19-22-15-10-18(28-3)17(27-2)9-13(15)21(26)24-19/h5-10H,4,11-12H2,1-3H3,(H,22,24,26)