1,3-diethyl-2-isothiocyanato-benzene

Systemtic Name: 1,3-diethyl-2-isothiocyanato-benzene Openeye Name: 1,3-diethyl-2-isothiocyanato-benzene CAS Name: 1,3-diethyl-2-isothiocyanatobenzene IUPAC Name: 1,3-diethyl-2-isothiocyanatobenzene Traditional Name: 1,3-diethyl-2-isothiocyanato-benzene Formula: C11H13NS MolecularWeight: 191.29262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N=C=S

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N=C=S

InChI

InChI=1S/C11H13NS/c1-3-9-6-5-7-10(4-2)11(9)12-8-13/h5-7H,3-4H2,1-2H3