N-(6-azanylhexyl)-4-butyl-N-[1-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzamide

Systemtic Name: N-(6-azanylhexyl)-4-butyl-N-[1-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzamide Openeye Name: N-(6-aminohexyl)-4-butyl-N-[1-[3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]ethyl]benzamide CAS Name: N-(6-aminohexyl)-4-butyl-N-[1-[3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]ethyl]benzamide IUPAC Name: N-(6-aminohexyl)-4-butyl-N-[1-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]ethyl]benzamide Traditional Name: N-(6-aminohexyl)-4-butyl-N-[1-[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]ethyl]benzamide Formula: C30H42N4O3 MolecularWeight: 506.67948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCCCCCN)C(C)C2=NC3=CC=CC=C3C(=O)N2CCOC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCCCCCN)C(C)C2=NC3=CC=CC=C3C(=O)N2CCOC

InChI

InChI=1S/C30H42N4O3/c1-4-5-12-24-15-17-25(18-16-24)29(35)33(20-11-7-6-10-19-31)23(2)28-32-27-14-9-8-13-26(27)30(36)34(28)21-22-37-3/h8-9,13-18,23H,4-7,10-12,19-22,31H2,1-3H3