methyl 2,4-bis(oxidanylidene)-3-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2,4-bis(oxidanylidene)-3-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 2,4-dioxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1H-quinazoline-7-carboxylate CAS Name: 2,4-dioxo-3-[4-oxo-4-(4-phenyl-1-piperazinyl)butyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dioxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1H-quinazoline-7-carboxylate Traditional Name: 2,4-diketo-3-[4-keto-4-(4-phenylpiperazino)butyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C24H26N4O5 MolecularWeight: 450.48704

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=O)N2)CCCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=O)N2)CCCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N4O5/c1-33-23(31)17-9-10-19-20(16-17)25-24(32)28(22(19)30)11-5-8-21(29)27-14-12-26(13-15-27)18-6-3-2-4-7-18/h2-4,6-7,9-10,16H,5,8,11-15H2,1H3,(H,25,32)