7-chloranyl-3-[4-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1H-quinazoline-2,4-dione

Systemtic Name: 7-chloranyl-3-[4-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1H-quinazoline-2,4-dione Openeye Name: 7-chloro-3-[4-oxo-4-[4-(2-pyridyl)piperazin-1-yl]butyl]-1H-quinazoline-2,4-dione CAS Name: 7-chloro-3-[4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-1H-quinazoline-2,4-dione IUPAC Name: 7-chloro-3-[4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1H-quinazoline-2,4-dione Traditional Name: 7-chloro-3-[4-keto-4-[4-(2-pyridyl)piperazino]butyl]-1H-quinazoline-2,4-quinone Formula: C21H22ClN5O3 MolecularWeight: 427.88408

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CCCN3C(=O)C4=C(C=C(C=C4)Cl)NC3=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CCCN3C(=O)C4=C(C=C(C=C4)Cl)NC3=O

InChI

InChI=1S/C21H22ClN5O3/c22-15-6-7-16-17(14-15)24-21(30)27(20(16)29)9-3-5-19(28)26-12-10-25(11-13-26)18-4-1-2-8-23-18/h1-2,4,6-8,14H,3,5,9-13H2,(H,24,30)