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

Systemtic Name: N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-1,1-bis(oxidanylidene)thian-4-amine Openeye Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-1,1-dioxo-thian-4-amine CAS Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-1,1-dioxo-4-thianamine IUPAC Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-1,1-dioxothian-4-amine Traditional Name: 1-(3-bromo-4-methoxy-phenyl)ethyl-(1,1-diketothian-4-yl)amine Formula: C14H20BrNO3S MolecularWeight: 362.2825

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NC2CCS(=O)(=O)CC2

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)Br)NC2CCS(=O)(=O)CC2

InChI

InChI=1S/C14H20BrNO3S/c1-10(11-3-4-14(19-2)13(15)9-11)16-12-5-7-20(17,18)8-6-12/h3-4,9-10,12,16H,5-8H2,1-2H3