1-(4-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanone

Systemtic Name: 1-(4-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanone Openeye Name: 1-(4-isothiocyanato-4,5,6,7-tetrahydrobenzothiophen-2-yl)ethanone CAS Name: 1-(4-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanone IUPAC Name: 1-(4-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanone Traditional Name: 1-(4-isothiocyanato-4,5,6,7-tetrahydrobenzothiophen-2-yl)ethanone Formula: C11H11NOS2 MolecularWeight: 237.34114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(S1)CCCC2N=C=S

Isomeric SMILES

CC(=O)C1=CC2=C(S1)CCCC2N=C=S

InChI

InChI=1S/C11H11NOS2/c1-7(13)11-5-8-9(12-6-14)3-2-4-10(8)15-11/h5,9H,2-4H2,1H3