N-[4-oxidanylidene-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]-4-propyl-cyclohexane-1-carboxamide

Systemtic Name: N-[4-oxidanylidene-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]-4-propyl-cyclohexane-1-carboxamide Openeye Name: N-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]-4-propyl-cyclohexanecarboxamide CAS Name: N-[4-oxo-2-(3,4,5-trimethoxyphenyl)-3-quinazolinyl]-4-propyl-1-cyclohexanecarboxamide IUPAC Name: N-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]-4-propylcyclohexane-1-carboxamide Traditional Name: N-[4-keto-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]-4-propyl-cyclohexanecarboxamide Formula: C27H33N3O5 MolecularWeight: 479.56802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C(=O)NN2C(=NC3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCCC1CCC(CC1)C(=O)NN2C(=NC3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C27H33N3O5/c1-5-8-17-11-13-18(14-12-17)26(31)29-30-25(28-21-10-7-6-9-20(21)27(30)32)19-15-22(33-2)24(35-4)23(16-19)34-3/h6-7,9-10,15-18H,5,8,11-14H2,1-4H3,(H,29,31)