5-[7-methoxy-4-[1-(phenylmethyl)indazol-5-yl]quinazolin-6-yl]furan-2-carbaldehyde hydrochloride

Systemtic Name: 5-[7-methoxy-4-[1-(phenylmethyl)indazol-5-yl]quinazolin-6-yl]furan-2-carbaldehyde hydrochloride Openeye Name: 5-[4-(1-benzylindazol-5-yl)-7-methoxy-quinazolin-6-yl]furan-2-carbaldehyde hydrochloride CAS Name: 5-[7-methoxy-4-[1-(phenylmethyl)-5-indazolyl]-6-quinazolinyl]-2-furancarboxaldehyde hydrochloride IUPAC Name: 5-[4-(1-benzylindazol-5-yl)-7-methoxyquinazolin-6-yl]furan-2-carbaldehyde hydrochloride Traditional Name: 5-[4-(1-benzylindazol-5-yl)-7-methoxy-quinazolin-6-yl]furfural hydrochloride Formula: C28H21ClN4O3 MolecularWeight: 496.94434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2C3=CC4=C(C=C3)N(N=C4)CC5=CC=CC=C5)C6=CC=C(O6)C=O.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2C3=CC4=C(C=C3)N(N=C4)CC5=CC=CC=C5)C6=CC=C(O6)C=O.Cl

InChI

InChI=1S/C28H20N4O3.ClH/c1-34-27-13-24-22(12-23(27)26-10-8-21(16-33)35-26)28(30-17-29-24)19-7-9-25-20(11-19)14-31-32(25)15-18-5-3-2-4-6-18;/h2-14,16-17H,15H2,1H3;1H