N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: 4-(4-ketoquinazolin-3-yl)-N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]butyramide Formula: C26H32N4O3 MolecularWeight: 448.55728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)CCCN2C=NC3=CC=CC=C3C2=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)CCCN2C=NC3=CC=CC=C3C2=O)N4CCCCC4

InChI

InChI=1S/C26H32N4O3/c1-33-21-13-11-20(12-14-21)24(29-15-5-2-6-16-29)18-27-25(31)10-7-17-30-19-28-23-9-4-3-8-22(23)26(30)32/h3-4,8-9,11-14,19,24H,2,5-7,10,15-18H2,1H3,(H,27,31)