2-[(2-azanyl-6-chloranyl-phenyl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(2-azanyl-6-chloranyl-phenyl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(2-amino-6-chloro-phenyl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[(2-amino-6-chlorophenyl)thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(2-amino-6-chlorophenyl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(2-amino-6-chloro-phenyl)thio]methyl]isoindoline-1,3-quinone Formula: C15H11ClN2O2S MolecularWeight: 318.77804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=C(C=CC=C3Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=C(C=CC=C3Cl)N

InChI

InChI=1S/C15H11ClN2O2S/c16-11-6-3-7-12(17)13(11)21-8-18-14(19)9-4-1-2-5-10(9)15(18)20/h1-7H,8,17H2