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

Systemtic Name: 4-(2-oxidanylidenepropyl)benzenesulfonamide; 1H-quinazolin-4-one Openeye Name: 4-acetonylbenzenesulfonamide; 1H-quinazolin-4-one CAS Name: 4-(2-oxopropyl)benzenesulfonamide; 1H-quinazolin-4-one IUPAC Name: 4-(2-oxopropyl)benzenesulfonamide; 1H-quinazolin-4-one Traditional Name: 4-acetonylbenzenesulfonamide; 1H-quinazolin-4-one Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO3S.C8H6N2O/c1-7(11)6-8-2-4-9(5-3-8)14(10,12)13;11-8-6-3-1-2-4-7(6)9-5-10-8/h2-5H,6H2,1H3,(H2,10,12,13);1-5H,(H,9,10,11)