1-butyl-3-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonyl]urea

Systemtic Name: 1-butyl-3-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonyl]urea Openeye Name: 1-butyl-3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonyl]urea CAS Name: 1-butyl-3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonyl]urea IUPAC Name: 1-butyl-3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonyl]urea Traditional Name: 1-butyl-3-[(3-keto-4H-1,4-benzoxazin-6-yl)sulfonyl]urea Formula: C13H17N3O5S MolecularWeight: 327.35618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC2=C(C=C1)OCC(=O)N2

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC2=C(C=C1)OCC(=O)N2

InChI

InChI=1S/C13H17N3O5S/c1-2-3-6-14-13(18)16-22(19,20)9-4-5-11-10(7-9)15-12(17)8-21-11/h4-5,7H,2-3,6,8H2,1H3,(H,15,17)(H2,14,16,18)