N-[1-[3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-4-pentyl-N-(phenylmethyl)benzamide

Systemtic Name: N-[1-[3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-4-pentyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[1-[3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-4-pentyl-benzamide CAS Name: N-[1-[3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-4-pentyl-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[1-[3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-benzyl-N-[1-[4-keto-3-(2-methoxyphenyl)quinazolin-2-yl]ethyl]benzamide Formula: C36H37N3O3 MolecularWeight: 559.69728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C(C)C3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C(C)C3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5OC

InChI

InChI=1S/C36H37N3O3/c1-4-5-7-14-27-21-23-29(24-22-27)35(40)38(25-28-15-8-6-9-16-28)26(2)34-37-31-18-11-10-17-30(31)36(41)39(34)32-19-12-13-20-33(32)42-3/h6,8-13,15-24,26H,4-5,7,14,25H2,1-3H3