N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: 4-keto-N-[2-(4-methoxyphenyl)-2-pyrrolidino-ethyl]-1H-quinazoline-2-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=NC(=O)C3=CC=CC=C3N2)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)C2=NC(=O)C3=CC=CC=C3N2)N4CCCC4

InChI

InChI=1S/C22H24N4O3/c1-29-16-10-8-15(9-11-16)19(26-12-4-5-13-26)14-23-22(28)20-24-18-7-3-2-6-17(18)21(27)25-20/h2-3,6-11,19H,4-5,12-14H2,1H3,(H,23,28)(H,24,25,27)