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

Systemtic Name: N-[6-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-2-yl]pyridine-3-carboxamide Openeye Name: N-[6-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-2-yl]pyridine-3-carboxamide CAS Name: N-[6-[(6,7-dimethoxy-4-quinazolinyl)amino]-1,3-benzothiazol-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[6-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-2-yl]pyridine-3-carboxamide Traditional Name: N-[6-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-2-yl]nicotinamide 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=CN=CC=C5)OC

Isomeric SMILES

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

InChI

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