2-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]-1H-quinazolin-4-one

Systemtic Name: 2-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]-1H-quinazolin-4-one Openeye Name: 2-[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]-1H-quinazolin-4-one CAS Name: 2-[2,5-dimethyl-1-[3-(4-morpholinylsulfonyl)phenyl]-3-pyrrolyl]-1H-quinazolin-4-one IUPAC Name: 2-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]-1H-quinazolin-4-one Traditional Name: 2-[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]-1H-quinazolin-4-one Formula: C24H24N4O4S MolecularWeight: 464.53676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)C4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)C4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C24H24N4O4S/c1-16-14-21(23-25-22-9-4-3-8-20(22)24(29)26-23)17(2)28(16)18-6-5-7-19(15-18)33(30,31)27-10-12-32-13-11-27/h3-9,14-15H,10-13H2,1-2H3,(H,25,26,29)