8-chloranyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-5,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 8-chloranyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-5,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 8-chloro-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-5,7-dimethoxy-1H-quinazolin-4-one CAS Name: 8-chloro-2-[2-ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-5,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 8-chloro-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-5,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 8-chloro-2-[2-ethoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-5,7-dimethoxy-1H-quinazolin-4-one Formula: C23H27ClN4O6S MolecularWeight: 523.00168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)C3=NC(=O)C4=C(N3)C(=C(C=C4OC)OC)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)C3=NC(=O)C4=C(N3)C(=C(C=C4OC)OC)Cl

InChI

InChI=1S/C23H27ClN4O6S/c1-5-34-16-7-6-14(35(30,31)28-10-8-27(2)9-11-28)12-15(16)22-25-21-19(23(29)26-22)17(32-3)13-18(33-4)20(21)24/h6-7,12-13H,5,8-11H2,1-4H3,(H,25,26,29)