1,3-diethyl-5-(2-ethylbutyl)-2-isothiocyanato-benzene

Systemtic Name: 1,3-diethyl-5-(2-ethylbutyl)-2-isothiocyanato-benzene Openeye Name: 1,3-diethyl-5-(2-ethylbutyl)-2-isothiocyanato-benzene CAS Name: 1,3-diethyl-5-(2-ethylbutyl)-2-isothiocyanatobenzene IUPAC Name: 1,3-diethyl-5-(2-ethylbutyl)-2-isothiocyanatobenzene Traditional Name: 1,3-diethyl-5-(2-ethylbutyl)-2-isothiocyanato-benzene Formula: C17H25NS MolecularWeight: 275.4521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1N=C=S)CC)CC(CC)CC

Isomeric SMILES

CCC1=CC(=CC(=C1N=C=S)CC)CC(CC)CC

InChI

InChI=1S/C17H25NS/c1-5-13(6-2)9-14-10-15(7-3)17(18-12-19)16(8-4)11-14/h10-11,13H,5-9H2,1-4H3