5-isothiocyanato-2-(6-phenylsulfanylpyridin-2-yl)-1,3-benzothiazole

Systemtic Name: 5-isothiocyanato-2-(6-phenylsulfanylpyridin-2-yl)-1,3-benzothiazole Openeye Name: 5-isothiocyanato-2-(6-phenylsulfanyl-2-pyridyl)-1,3-benzothiazole CAS Name: 5-isothiocyanato-2-[6-(phenylthio)-2-pyridinyl]-1,3-benzothiazole IUPAC Name: 5-isothiocyanato-2-(6-phenylsulfanylpyridin-2-yl)-1,3-benzothiazole Traditional Name: 5-isothiocyanato-2-[6-(phenylthio)-2-pyridyl]-1,3-benzothiazole Formula: C19H11N3S3 MolecularWeight: 377.50574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC(=N2)C3=NC4=C(S3)C=CC(=C4)N=C=S

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC(=N2)C3=NC4=C(S3)C=CC(=C4)N=C=S

InChI

InChI=1S/C19H11N3S3/c23-12-20-13-9-10-17-16(11-13)22-19(25-17)15-7-4-8-18(21-15)24-14-5-2-1-3-6-14/h1-11H