2-[(4-chloranyl-2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(4-chloranyl-2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(4-chloro-2-thioxo-1,3-benzothiazol-3-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[(4-chloro-2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(4-chloro-2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(4-chloro-2-thioxo-1,3-benzothiazol-3-yl)methyl]isoindoline-1,3-quinone Formula: C16H9ClN2O2S2 MolecularWeight: 360.83786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CN3C4=C(C=CC=C4Cl)SC3=S

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CN3C4=C(C=CC=C4Cl)SC3=S

InChI

InChI=1S/C16H9ClN2O2S2/c17-11-6-3-7-12-13(11)18(16(22)23-12)8-19-14(20)9-4-1-2-5-10(9)15(19)21/h1-7H,8H2