3-[4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione

Systemtic Name: 3-[4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione Openeye Name: 3-[4-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-4-oxo-butyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione CAS Name: 3-[4-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-4-oxobutyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione IUPAC Name: 3-[4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-oxobutyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione Traditional Name: 3-[4-[4-(5-chloro-2-methyl-phenyl)piperazino]-4-keto-butyl]-6,7-dimethoxy-1H-quinazoline-2,4-quinone Formula: C25H29ClN4O5 MolecularWeight: 500.97456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCCN3C(=O)C4=CC(=C(C=C4NC3=O)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCCN3C(=O)C4=CC(=C(C=C4NC3=O)OC)OC

InChI

InChI=1S/C25H29ClN4O5/c1-16-6-7-17(26)13-20(16)28-9-11-29(12-10-28)23(31)5-4-8-30-24(32)18-14-21(34-2)22(35-3)15-19(18)27-25(30)33/h6-7,13-15H,4-5,8-12H2,1-3H3,(H,27,33)