1-[4-ethoxy-3-(4-oxidanylidene-1H-quinazolin-2-yl)phenyl]sulfonylpiperidine-4-carboxamide

Systemtic Name: 1-[4-ethoxy-3-(4-oxidanylidene-1H-quinazolin-2-yl)phenyl]sulfonylpiperidine-4-carboxamide Openeye Name: 1-[4-ethoxy-3-(4-oxo-1H-quinazolin-2-yl)phenyl]sulfonylpiperidine-4-carboxamide CAS Name: 1-[4-ethoxy-3-(4-oxo-1H-quinazolin-2-yl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-[4-ethoxy-3-(4-oxo-1H-quinazolin-2-yl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: 1-[4-ethoxy-3-(4-keto-1H-quinazolin-2-yl)phenyl]sulfonylisonipecotamide Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N)C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H24N4O5S/c1-2-31-19-8-7-15(32(29,30)26-11-9-14(10-12-26)20(23)27)13-17(19)21-24-18-6-4-3-5-16(18)22(28)25-21/h3-8,13-14H,2,9-12H2,1H3,(H2,23,27)(H,24,25,28)