N-(6-azanylhexyl)-4-butoxy-N-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]benzamide

Systemtic Name: N-(6-azanylhexyl)-4-butoxy-N-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]benzamide Openeye Name: N-(6-aminohexyl)-4-butoxy-N-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]benzamide CAS Name: N-(6-aminohexyl)-4-butoxy-N-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]benzamide IUPAC Name: N-(6-aminohexyl)-4-butoxy-N-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]benzamide Traditional Name: N-(6-aminohexyl)-4-butoxy-N-[1-(4-keto-1H-quinazolin-2-yl)ethyl]benzamide Formula: C27H36N4O3 MolecularWeight: 464.59974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N(CCCCCCN)C(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N(CCCCCCN)C(C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C27H36N4O3/c1-3-4-19-34-22-15-13-21(14-16-22)27(33)31(18-10-6-5-9-17-28)20(2)25-29-24-12-8-7-11-23(24)26(32)30-25/h7-8,11-16,20H,3-6,9-10,17-19,28H2,1-2H3,(H,29,30,32)