1-(5-bromanylthiophen-2-yl)sulfonyl-N-(4-oxidanylidenequinazolin-3-yl)piperidine-3-carboxamide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-(4-oxidanylidenequinazolin-3-yl)piperidine-3-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(4-oxoquinazolin-3-yl)piperidine-3-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(4-oxo-3-quinazolinyl)-3-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-(4-oxoquinazolin-3-yl)piperidine-3-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(4-ketoquinazolin-3-yl)nipecotamide Formula: C18H17BrN4O4S2 MolecularWeight: 497.38598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(S2)Br)C(=O)NN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(S2)Br)C(=O)NN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C18H17BrN4O4S2/c19-15-7-8-16(28-15)29(26,27)22-9-3-4-12(10-22)17(24)21-23-11-20-14-6-2-1-5-13(14)18(23)25/h1-2,5-8,11-12H,3-4,9-10H2,(H,21,24)