N-(6-azanylhexyl)-4-butyl-N-[1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]benzamide

Systemtic Name: N-(6-azanylhexyl)-4-butyl-N-[1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]benzamide Openeye Name: N-(6-aminohexyl)-4-butyl-N-[1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]benzamide CAS Name: N-(6-aminohexyl)-4-butyl-N-[1-(7-chloro-3-methyl-4-oxo-2-quinazolinyl)ethyl]benzamide IUPAC Name: N-(6-aminohexyl)-4-butyl-N-[1-(7-chloro-3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide Traditional Name: N-(6-aminohexyl)-4-butyl-N-[1-(7-chloro-4-keto-3-methyl-quinazolin-2-yl)ethyl]benzamide Formula: C28H37ClN4O2 MolecularWeight: 497.07198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCCCCCN)C(C)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCCCCCN)C(C)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2C

InChI

InChI=1S/C28H37ClN4O2/c1-4-5-10-21-11-13-22(14-12-21)27(34)33(18-9-7-6-8-17-30)20(2)26-31-25-19-23(29)15-16-24(25)28(35)32(26)3/h11-16,19-20H,4-10,17-18,30H2,1-3H3