8-butyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-7-methoxy-5-oxidanyl-1H-quinazolin-4-one

Systemtic Name: 8-butyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-7-methoxy-5-oxidanyl-1H-quinazolin-4-one Openeye Name: 8-butyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-5-hydroxy-7-methoxy-1H-quinazolin-4-one CAS Name: 8-butyl-2-[2-ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-5-hydroxy-7-methoxy-1H-quinazolin-4-one IUPAC Name: 8-butyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-5-hydroxy-7-methoxy-1H-quinazolin-4-one Traditional Name: 8-butyl-2-[2-ethoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-5-hydroxy-7-methoxy-1H-quinazolin-4-one Formula: C26H34N4O6S MolecularWeight: 530.63636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)O)OC

Isomeric SMILES

CCCCC1=C(C=C(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)O)OC

InChI

InChI=1S/C26H34N4O6S/c1-5-7-8-18-22(35-4)16-20(31)23-24(18)27-25(28-26(23)32)19-15-17(9-10-21(19)36-6-2)37(33,34)30-13-11-29(3)12-14-30/h9-10,15-16,31H,5-8,11-14H2,1-4H3,(H,27,28,32)