1-benzothiophen-3-yl-(3-methylsulfonylphenyl)methanamine

Systemtic Name: 1-benzothiophen-3-yl-(3-methylsulfonylphenyl)methanamine Openeye Name: benzothiophen-3-yl-(3-methylsulfonylphenyl)methanamine CAS Name: 1-benzothiophen-3-yl-(3-methylsulfonylphenyl)methanamine IUPAC Name: 1-benzothiophen-3-yl-(3-methylsulfonylphenyl)methanamine Traditional Name: [benzothiophen-3-yl-(3-mesylphenyl)methyl]amine Formula: C16H15NO2S2 MolecularWeight: 317.4258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(C2=CSC3=CC=CC=C32)N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(C2=CSC3=CC=CC=C32)N

InChI

InChI=1S/C16H15NO2S2/c1-21(18,19)12-6-4-5-11(9-12)16(17)14-10-20-15-8-3-2-7-13(14)15/h2-10,16H,17H2,1H3