(3E)-3-[7-(2-morpholin-4-ylethoxy)-1H-quinazolin-4-ylidene]-2-oxidanylidene-1H-indole-5-carbonitrile dihydrochloride

Systemtic Name: (3E)-3-[7-(2-morpholin-4-ylethoxy)-1H-quinazolin-4-ylidene]-2-oxidanylidene-1H-indole-5-carbonitrile dihydrochloride Openeye Name: (3E)-3-[7-(2-morpholinoethoxy)-1H-quinazolin-4-ylidene]-2-oxo-indoline-5-carbonitrile dihydrochloride CAS Name: (3E)-3-[7-[2-(4-morpholinyl)ethoxy]-1H-quinazolin-4-ylidene]-2-oxo-1H-indole-5-carbonitrile dihydrochloride IUPAC Name: (3E)-3-[7-(2-morpholin-4-ylethoxy)-1H-quinazolin-4-ylidene]-2-oxo-1H-indole-5-carbonitrile dihydrochloride Traditional Name: (3E)-2-keto-3-[7-(2-morpholinoethoxy)-1H-quinazolin-4-ylidene]indoline-5-carbonitrile dihydrochloride Formula: C23H23Cl2N5O3 MolecularWeight: 488.36642

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOC2=CC3=C(C=C2)C(=C4C5=C(C=CC(=C5)C#N)NC4=O)N=CN3.Cl.Cl

Isomeric SMILES

C1COCCN1CCOC2=CC3=C(C=C2)/C(=C\4/C5=C(C=CC(=C5)C#N)NC4=O)/N=CN3.Cl.Cl

InChI

InChI=1S/C23H21N5O3.2ClH/c24-13-15-1-4-19-18(11-15)21(23(29)27-19)22-17-3-2-16(12-20(17)25-14-26-22)31-10-7-28-5-8-30-9-6-28;;/h1-4,11-12,14H,5-10H2,(H,25,26)(H,27,29);2*1H/b22-21+;;