N-[(3Z)-3-[(3-ethoxyphenyl)methylidene]-9-oxidanylidene-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]-2-(4-methylpiperazin-1-yl)ethanamide

Systemtic Name: N-[(3Z)-3-[(3-ethoxyphenyl)methylidene]-9-oxidanylidene-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]-2-(4-methylpiperazin-1-yl)ethanamide Openeye Name: N-[(3Z)-3-[(3-ethoxyphenyl)methylene]-9-oxo-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]-2-(4-methylpiperazin-1-yl)acetamide CAS Name: N-[(3Z)-3-[(3-ethoxyphenyl)methylidene]-9-oxo-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]-2-(4-methyl-1-piperazinyl)acetamide IUPAC Name: N-[(3Z)-3-[(3-ethoxyphenyl)methylidene]-9-oxo-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]-2-(4-methylpiperazin-1-yl)acetamide Traditional Name: N-[(3Z)-3-(3-ethoxybenzylidene)-9-keto-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]-2-(4-methylpiperazino)acetamide Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C=C2CCN3C2=NC4=C(C3=O)C=CC(=C4)NC(=O)CN5CCN(CC5)C

Isomeric SMILES

CCOC1=CC=CC(=C1)/C=C\2/CCN3C2=NC4=C(C3=O)C=CC(=C4)NC(=O)CN5CCN(CC5)C

InChI

InChI=1S/C27H31N5O3/c1-3-35-22-6-4-5-19(16-22)15-20-9-10-32-26(20)29-24-17-21(7-8-23(24)27(32)34)28-25(33)18-31-13-11-30(2)12-14-31/h4-8,15-17H,3,9-14,18H2,1-2H3,(H,28,33)/b20-15-