N-[(3-bromophenyl)methyl]-1,1-bis(oxidanylidene)thian-4-amine

Systemtic Name: N-[(3-bromophenyl)methyl]-1,1-bis(oxidanylidene)thian-4-amine Openeye Name: N-[(3-bromophenyl)methyl]-1,1-dioxo-thian-4-amine CAS Name: N-[(3-bromophenyl)methyl]-1,1-dioxo-4-thianamine IUPAC Name: N-[(3-bromophenyl)methyl]-1,1-dioxothian-4-amine Traditional Name: (3-bromobenzyl)-(1,1-diketothian-4-yl)amine Formula: C12H16BrNO2S MolecularWeight: 318.22994

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NCC2=CC(=CC=C2)Br

Isomeric SMILES

C1CS(=O)(=O)CCC1NCC2=CC(=CC=C2)Br

InChI

InChI=1S/C12H16BrNO2S/c13-11-3-1-2-10(8-11)9-14-12-4-6-17(15,16)7-5-12/h1-3,8,12,14H,4-7,9H2