N-butyl-2-(3-ethoxyphenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4H-quinazoline-7-carboxamide

Systemtic Name: N-butyl-2-(3-ethoxyphenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4H-quinazoline-7-carboxamide Openeye Name: N-butyl-2-(3-ethoxyphenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]-4H-quinazoline-7-carboxamide CAS Name: N-butyl-2-(3-ethoxyphenyl)-3-[3-(2-oxo-1-pyrrolidinyl)propyl]-4H-quinazoline-7-carboxamide IUPAC Name: N-butyl-2-(3-ethoxyphenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]-4H-quinazoline-7-carboxamide Traditional Name: N-butyl-3-[3-(2-ketopyrrolidino)propyl]-2-m-phenetyl-4H-quinazoline-7-carboxamide Formula: C28H36N4O3 MolecularWeight: 476.61044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC2=C(CN(C(=N2)C3=CC(=CC=C3)OCC)CCCN4CCCC4=O)C=C1

Isomeric SMILES

CCCCNC(=O)C1=CC2=C(CN(C(=N2)C3=CC(=CC=C3)OCC)CCCN4CCCC4=O)C=C1

InChI

InChI=1S/C28H36N4O3/c1-3-5-14-29-28(34)22-12-13-23-20-32(17-8-16-31-15-7-11-26(31)33)27(30-25(23)19-22)21-9-6-10-24(18-21)35-4-2/h6,9-10,12-13,18-19H,3-5,7-8,11,14-17,20H2,1-2H3,(H,29,34)