2-(aminocarbonylamino)-N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-methylsulfanyl-butanamide

Systemtic Name: 2-(aminocarbonylamino)-N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-methylsulfanyl-butanamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methylsulfanyl-2-ureido-butanamide CAS Name: 2-(carbamoylamino)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-(methylthio)butanamide IUPAC Name: 2-(carbamoylamino)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methylsulfanylbutanamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-(methylthio)-2-ureido-butyramide Formula: C13H15F2N3O4S MolecularWeight: 347.337706

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC2=C(C=C1)OC(O2)(F)F)NC(=O)N

Isomeric SMILES

CSCCC(C(=O)NC1=CC2=C(C=C1)OC(O2)(F)F)NC(=O)N

InChI

InChI=1S/C13H15F2N3O4S/c1-23-5-4-8(18-12(16)20)11(19)17-7-2-3-9-10(6-7)22-13(14,15)21-9/h2-3,6,8H,4-5H2,1H3,(H,17,19)(H3,16,18,20)