4-phenyl-1-(phenylcarbonyl)spiro[1,5-benzodiazepine-3,2'-3H-1,3-benzothiazole]-2-one

Systemtic Name: 4-phenyl-1-(phenylcarbonyl)spiro[1,5-benzodiazepine-3,2'-3H-1,3-benzothiazole]-2-one Openeye Name: 1-benzoyl-4-phenyl-spiro[1,5-benzodiazepine-3,2'-3H-1,3-benzothiazole]-2-one CAS Name: 1-benzoyl-4-phenyl-2-spiro[1,5-benzodiazepine-3,2'-3H-1,3-benzothiazole]one IUPAC Name: 1-benzoyl-4-phenylspiro[1,5-benzodiazepine-3,2'-3H-1,3-benzothiazole]-2-one Traditional Name: 1-benzoyl-4-phenyl-spiro[1,5-benzodiazepine-3,2'-3H-1,3-benzothiazole]-2-one Formula: C28H19N3O2S MolecularWeight: 461.53436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3N(C(=O)C24NC5=CC=CC=C5S4)C(=O)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3N(C(=O)C24NC5=CC=CC=C5S4)C(=O)C6=CC=CC=C6

InChI

InChI=1S/C28H19N3O2S/c32-26(20-13-5-2-6-14-20)31-23-17-9-7-15-21(23)29-25(19-11-3-1-4-12-19)28(27(31)33)30-22-16-8-10-18-24(22)34-28/h1-18,30H