N-[(3-bromanyl-4-methoxy-phenyl)methyl]-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: N-[(3-bromanyl-4-methoxy-phenyl)methyl]-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: N-[(3-bromo-4-methoxy-phenyl)methyl]-1,1-dioxo-thiolan-3-amine CAS Name: N-[(3-bromo-4-methoxyphenyl)methyl]-1,1-dioxo-3-thiolanamine IUPAC Name: N-[(3-bromo-4-methoxyphenyl)methyl]-1,1-dioxothiolan-3-amine Traditional Name: (3-bromo-4-methoxy-benzyl)-(1,1-diketothiolan-3-yl)amine Formula: C12H16BrNO3S MolecularWeight: 334.22934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2CCS(=O)(=O)C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2CCS(=O)(=O)C2)Br

InChI

InChI=1S/C12H16BrNO3S/c1-17-12-3-2-9(6-11(12)13)7-14-10-4-5-18(15,16)8-10/h2-3,6,10,14H,4-5,7-8H2,1H3