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

Systemtic Name: N-[(3-bromanyl-4-methoxy-phenyl)methyl]-1,1-bis(oxidanylidene)thian-4-amine Openeye Name: N-[(3-bromo-4-methoxy-phenyl)methyl]-1,1-dioxo-thian-4-amine CAS Name: N-[(3-bromo-4-methoxyphenyl)methyl]-1,1-dioxo-4-thianamine IUPAC Name: N-[(3-bromo-4-methoxyphenyl)methyl]-1,1-dioxothian-4-amine Traditional Name: (3-bromo-4-methoxy-benzyl)-(1,1-diketothian-4-yl)amine Formula: C13H18BrNO3S MolecularWeight: 348.25592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2CCS(=O)(=O)CC2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2CCS(=O)(=O)CC2)Br

InChI

InChI=1S/C13H18BrNO3S/c1-18-13-3-2-10(8-12(13)14)9-15-11-4-6-19(16,17)7-5-11/h2-3,8,11,15H,4-7,9H2,1H3