N-[[3,5-bis(bromanyl)-4-methoxy-phenyl]methyl]-1,1-bis(oxidanylidene)thian-4-amine

Systemtic Name: N-[[3,5-bis(bromanyl)-4-methoxy-phenyl]methyl]-1,1-bis(oxidanylidene)thian-4-amine Openeye Name: N-[(3,5-dibromo-4-methoxy-phenyl)methyl]-1,1-dioxo-thian-4-amine CAS Name: N-[(3,5-dibromo-4-methoxyphenyl)methyl]-1,1-dioxo-4-thianamine IUPAC Name: N-[(3,5-dibromo-4-methoxyphenyl)methyl]-1,1-dioxothian-4-amine Traditional Name: (3,5-dibromo-4-methoxy-benzyl)-(1,1-diketothian-4-yl)amine Formula: C13H17Br2NO3S MolecularWeight: 427.15198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)CNC2CCS(=O)(=O)CC2)Br

Isomeric SMILES

COC1=C(C=C(C=C1Br)CNC2CCS(=O)(=O)CC2)Br

InChI

InChI=1S/C13H17Br2NO3S/c1-19-13-11(14)6-9(7-12(13)15)8-16-10-2-4-20(17,18)5-3-10/h6-7,10,16H,2-5,8H2,1H3