N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[(4-morpholinosulfonylphenyl)methyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)-N-(4-morpholinosulfonylbenzyl)propionamide Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H24N4O5S/c27-21(10-9-20-24-19-4-2-1-3-18(19)22(28)25-20)23-15-16-5-7-17(8-6-16)32(29,30)26-11-13-31-14-12-26/h1-8H,9-15H2,(H,23,27)(H,24,25,28)