N-[(7-bromanyl-1,3-benzodioxol-5-yl)methyl]-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: N-[(7-bromanyl-1,3-benzodioxol-5-yl)methyl]-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-1,1-dioxo-thiolan-3-amine CAS Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-1,1-dioxo-3-thiolanamine IUPAC Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-1,1-dioxothiolan-3-amine Traditional Name: (7-bromo-1,3-benzodioxol-5-yl)methyl-(1,1-diketothiolan-3-yl)amine Formula: C12H14BrNO4S MolecularWeight: 348.21286

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NCC2=CC3=C(C(=C2)Br)OCO3

Isomeric SMILES

C1CS(=O)(=O)CC1NCC2=CC3=C(C(=C2)Br)OCO3

InChI

InChI=1S/C12H14BrNO4S/c13-10-3-8(4-11-12(10)18-7-17-11)5-14-9-1-2-19(15,16)6-9/h3-4,9,14H,1-2,5-7H2