4-(2-oxidanylidenebutyl)benzenesulfonamide; 1H-quinazolin-4-one

Systemtic Name: 4-(2-oxidanylidenebutyl)benzenesulfonamide; 1H-quinazolin-4-one Openeye Name: 4-(2-oxobutyl)benzenesulfonamide; 1H-quinazolin-4-one CAS Name: 4-(2-oxobutyl)benzenesulfonamide; 1H-quinazolin-4-one IUPAC Name: 4-(2-oxobutyl)benzenesulfonamide; 1H-quinazolin-4-one Traditional Name: 4-(2-ketobutyl)benzenesulfonamide; 1H-quinazolin-4-one Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1=CC=C(C=C1)S(=O)(=O)N.C1=CC=C2C(=C1)C(=O)N=CN2

Isomeric SMILES

CCC(=O)CC1=CC=C(C=C1)S(=O)(=O)N.C1=CC=C2C(=C1)C(=O)N=CN2

InChI

InChI=1S/C10H13NO3S.C8H6N2O/c1-2-9(12)7-8-3-5-10(6-4-8)15(11,13)14;11-8-6-3-1-2-4-7(6)9-5-10-8/h3-6H,2,7H2,1H3,(H2,11,13,14);1-5H,(H,9,10,11)