N-[[1-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]piperidin-2-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]piperidin-2-yl]methyl]methanesulfonamide Openeye Name: N-[[1-[3-(6-bromo-4-oxo-quinazolin-3-yl)propanoyl]-2-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-[3-(6-bromo-4-oxo-3-quinazolinyl)-1-oxopropyl]-2-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[1-[3-(6-bromo-4-oxoquinazolin-3-yl)propanoyl]piperidin-2-yl]methyl]methanesulfonamide Traditional Name: N-[[1-[3-(6-bromo-4-keto-quinazolin-3-yl)propanoyl]-2-piperidyl]methyl]methanesulfonamide Formula: C18H23BrN4O4S MolecularWeight: 471.36862

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1CCCCN1C(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CS(=O)(=O)NCC1CCCCN1C(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C18H23BrN4O4S/c1-28(26,27)21-11-14-4-2-3-8-23(14)17(24)7-9-22-12-20-16-6-5-13(19)10-15(16)18(22)25/h5-6,10,12,14,21H,2-4,7-9,11H2,1H3