1,3-diethyl-2-isothiocyanato-5-propan-2-yl-benzene

Systemtic Name: 1,3-diethyl-2-isothiocyanato-5-propan-2-yl-benzene Openeye Name: 1,3-diethyl-5-isopropyl-2-isothiocyanato-benzene CAS Name: 1,3-diethyl-2-isothiocyanato-5-propan-2-ylbenzene IUPAC Name: 1,3-diethyl-2-isothiocyanato-5-propan-2-ylbenzene Traditional Name: 1,3-diethyl-5-isopropyl-2-isothiocyanato-benzene Formula: C14H19NS MolecularWeight: 233.37236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NS/c1-5-11-7-13(10(3)4)8-12(6-2)14(11)15-9-16/h7-8,10H,5-6H2,1-4H3