1-[5-(2-methyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]ethanone

Systemtic Name: 1-[5-(2-methyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]ethanone Openeye Name: 1-[5-(2-methyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]ethanone CAS Name: 1-[5-(2-methyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]ethanone IUPAC Name: 1-[5-(2-methyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]ethanone Traditional Name: 1-[5-(2-methyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]ethanone Formula: C14H13NOS2 MolecularWeight: 275.38912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C2(SC3=CC=CC=C3S2)C

Isomeric SMILES

CC(=O)C1=CNC(=C1)C2(SC3=CC=CC=C3S2)C

InChI

InChI=1S/C14H13NOS2/c1-9(16)10-7-13(15-8-10)14(2)17-11-5-3-4-6-12(11)18-14/h3-8,15H,1-2H3