2-[(4-azanyl-2-chloranyl-phenyl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(4-azanyl-2-chloranyl-phenyl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(4-amino-2-chloro-phenyl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[(4-amino-2-chlorophenyl)thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(4-amino-2-chlorophenyl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(4-amino-2-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=C(C=C3)N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=C(C=C(C=C3)N)Cl

InChI

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