3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzenecarbothioamide

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzenecarbothioamide Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)benzenecarbothioamide CAS Name: 3-(5-bromo-1,3-dioxo-2-isoindolyl)benzenecarbothioamide IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)benzenecarbothioamide Traditional Name: 3-(5-bromo-1,3-diketo-isoindolin-2-yl)thiobenzamide Formula: C15H9BrN2O2S MolecularWeight: 361.21316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)Br)C(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)Br)C(=S)N

InChI

InChI=1S/C15H9BrN2O2S/c16-9-4-5-11-12(7-9)15(20)18(14(11)19)10-3-1-2-8(6-10)13(17)21/h1-7H,(H2,17,21)