N-[[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]methyl]-4-[4-(2-methoxyphenyl)piperazin-1-yl]butanamide

Systemtic Name: N-[[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]methyl]-4-[4-(2-methoxyphenyl)piperazin-1-yl]butanamide Openeye Name: N-[[3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]methyl]-4-[4-(2-methoxyphenyl)piperazin-1-yl]butanamide CAS Name: N-[[3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]methyl]-4-[4-(2-methoxyphenyl)-1-piperazinyl]butanamide IUPAC Name: N-[[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]methyl]-4-[4-(2-methoxyphenyl)piperazin-1-yl]butanamide Traditional Name: N-[[4-keto-3-(4-methoxyphenyl)quinazolin-2-yl]methyl]-4-[4-(2-methoxyphenyl)piperazino]butyramide Formula: C31H35N5O4 MolecularWeight: 541.6407

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CNC(=O)CCCN4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CNC(=O)CCCN4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C31H35N5O4/c1-39-24-15-13-23(14-16-24)36-29(33-26-9-4-3-8-25(26)31(36)38)22-32-30(37)12-7-17-34-18-20-35(21-19-34)27-10-5-6-11-28(27)40-2/h3-6,8-11,13-16H,7,12,17-22H2,1-2H3,(H,32,37)