1,3,5-tris(2-isothiocyanatoethyl)-2,4,6-trimethyl-benzene

Systemtic Name: 1,3,5-tris(2-isothiocyanatoethyl)-2,4,6-trimethyl-benzene Openeye Name: 1,3,5-tris(2-isothiocyanatoethyl)-2,4,6-trimethyl-benzene CAS Name: 1,3,5-tris(2-isothiocyanatoethyl)-2,4,6-trimethylbenzene IUPAC Name: 1,3,5-tris(2-isothiocyanatoethyl)-2,4,6-trimethylbenzene Traditional Name: 1,3,5-tris(2-isothiocyanatoethyl)-2,4,6-trimethyl-benzene Formula: C18H21N3S3 MolecularWeight: 375.57444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1CCN=C=S)C)CCN=C=S)C)CCN=C=S

Isomeric SMILES

CC1=C(C(=C(C(=C1CCN=C=S)C)CCN=C=S)C)CCN=C=S

InChI

InChI=1S/C18H21N3S3/c1-13-16(4-7-19-10-22)14(2)18(6-9-21-12-24)15(3)17(13)5-8-20-11-23/h4-9H2,1-3H3