1-(diisothiocyanatomethyl)-4-methyl-benzene

Systemtic Name: 1-(diisothiocyanatomethyl)-4-methyl-benzene Openeye Name: 1-(diisothiocyanatomethyl)-4-methyl-benzene CAS Name: 1-(diisothiocyanatomethyl)-4-methylbenzene IUPAC Name: 1-(diisothiocyanatomethyl)-4-methylbenzene Traditional Name: 1-(diisothiocyanatomethyl)-4-methyl-benzene Formula: C10H8N2S2 MolecularWeight: 220.31392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(N=C=S)N=C=S

Isomeric SMILES

CC1=CC=C(C=C1)C(N=C=S)N=C=S

InChI

InChI=1S/C10H8N2S2/c1-8-2-4-9(5-3-8)10(11-6-13)12-7-14/h2-5,10H,1H3