1-butyl-3-[4-[1-(4-oxidanylidenequinazolin-3-yl)ethyl]phenyl]sulfonyl-urea

Systemtic Name: 1-butyl-3-[4-[1-(4-oxidanylidenequinazolin-3-yl)ethyl]phenyl]sulfonyl-urea Openeye Name: 1-butyl-3-[4-[1-(4-oxoquinazolin-3-yl)ethyl]phenyl]sulfonyl-urea CAS Name: 1-butyl-3-[4-[1-(4-oxo-3-quinazolinyl)ethyl]phenyl]sulfonylurea IUPAC Name: 1-butyl-3-[4-[1-(4-oxoquinazolin-3-yl)ethyl]phenyl]sulfonylurea Traditional Name: 1-butyl-3-[4-[1-(4-ketoquinazolin-3-yl)ethyl]phenyl]sulfonyl-urea Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C(C)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C(C)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H24N4O4S/c1-3-4-13-22-21(27)24-30(28,29)17-11-9-16(10-12-17)15(2)25-14-23-19-8-6-5-7-18(19)20(25)26/h5-12,14-15H,3-4,13H2,1-2H3,(H2,22,24,27)