N-[6-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide

Systemtic Name: N-[6-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide Openeye Name: N-[6-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide CAS Name: N-[6-[(6,7-dimethoxy-4-quinazolinyl)amino]-1,3-benzothiazol-2-yl]-4-pyridinecarboxamide IUPAC Name: N-[6-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide Traditional Name: N-[6-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-2-yl]isonicotinamide Formula: C23H18N6O3S MolecularWeight: 458.49242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)N=C(S4)NC(=O)C5=CC=NC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)N=C(S4)NC(=O)C5=CC=NC=C5)OC

InChI

InChI=1S/C23H18N6O3S/c1-31-18-10-15-17(11-19(18)32-2)25-12-26-21(15)27-14-3-4-16-20(9-14)33-23(28-16)29-22(30)13-5-7-24-8-6-13/h3-12H,1-2H3,(H,25,26,27)(H,28,29,30)