2-(4-isothiocyanatophenyl)-1,3-benzothiazole

Systemtic Name: 2-(4-isothiocyanatophenyl)-1,3-benzothiazole Openeye Name: 2-(4-isothiocyanatophenyl)-1,3-benzothiazole CAS Name: 2-(4-isothiocyanatophenyl)-1,3-benzothiazole IUPAC Name: 2-(4-isothiocyanatophenyl)-1,3-benzothiazole Traditional Name: 2-(4-isothiocyanatophenyl)-1,3-benzothiazole Formula: C14H8N2S2 MolecularWeight: 268.35672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)N=C=S

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C14H8N2S2/c17-9-15-11-7-5-10(6-8-11)14-16-12-3-1-2-4-13(12)18-14/h1-8H