N-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]quinazolin-2-yl]methyl]-3-phenoxy-propanamide

Systemtic Name: N-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]quinazolin-2-yl]methyl]-3-phenoxy-propanamide Openeye Name: N-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]quinazolin-2-yl]methyl]-3-phenoxy-propanamide CAS Name: N-[[4-[4-(2-methoxyphenyl)-1-piperazinyl]-2-quinazolinyl]methyl]-3-phenoxypropanamide IUPAC Name: N-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]quinazolin-2-yl]methyl]-3-phenoxypropanamide Traditional Name: N-[[4-[4-(2-methoxyphenyl)piperazino]quinazolin-2-yl]methyl]-3-phenoxy-propionamide Formula: C29H31N5O3 MolecularWeight: 497.58814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=NC(=NC4=CC=CC=C43)CNC(=O)CCOC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=NC(=NC4=CC=CC=C43)CNC(=O)CCOC5=CC=CC=C5

InChI

InChI=1S/C29H31N5O3/c1-36-26-14-8-7-13-25(26)33-16-18-34(19-17-33)29-23-11-5-6-12-24(23)31-27(32-29)21-30-28(35)15-20-37-22-9-3-2-4-10-22/h2-14H,15-21H2,1H3,(H,30,35)