N-[4-[2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide CAS Name: N-[4-[2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-1-oxopropyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-(3-butyl-4-oxoquinazolin-2-yl)sulfanylpropanoyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-[(3-butyl-4-keto-quinazolin-2-yl)thio]propanoyl]phenyl]methanesulfonamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C

InChI

InChI=1S/C22H25N3O4S2/c1-4-5-14-25-21(27)18-8-6-7-9-19(18)23-22(25)30-15(2)20(26)16-10-12-17(13-11-16)24-31(3,28)29/h6-13,15,24H,4-5,14H2,1-3H3