3-[2-[(6,7-dimethoxyquinazolin-4-yl)-methyl-amino]-1,3-thiazol-5-yl]propanoic acid

Systemtic Name: 3-[2-[(6,7-dimethoxyquinazolin-4-yl)-methyl-amino]-1,3-thiazol-5-yl]propanoic acid Openeye Name: 3-[2-[(6,7-dimethoxyquinazolin-4-yl)-methyl-amino]thiazol-5-yl]propanoic acid CAS Name: 3-[2-[(6,7-dimethoxy-4-quinazolinyl)-methylamino]-5-thiazolyl]propanoic acid IUPAC Name: 3-[2-[(6,7-dimethoxyquinazolin-4-yl)-methylamino]-1,3-thiazol-5-yl]propanoic acid Traditional Name: 3-[2-[(6,7-dimethoxyquinazolin-4-yl)-methyl-amino]thiazol-5-yl]propionic acid Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC=NC2=CC(=C(C=C21)OC)OC)C3=NC=C(S3)CCC(=O)O

Isomeric SMILES

CN(C1=NC=NC2=CC(=C(C=C21)OC)OC)C3=NC=C(S3)CCC(=O)O

InChI

InChI=1S/C17H18N4O4S/c1-21(17-18-8-10(26-17)4-5-15(22)23)16-11-6-13(24-2)14(25-3)7-12(11)19-9-20-16/h6-9H,4-5H2,1-3H3,(H,22,23)