(3aR,8bR)-8b-oxidanyl-4-oxidanylidene-3-phenyl-3aH-indeno[1,2-c]pyrazole-1-carbothioamide

Systemtic Name: (3aR,8bR)-8b-oxidanyl-4-oxidanylidene-3-phenyl-3aH-indeno[1,2-c]pyrazole-1-carbothioamide Openeye Name: (3aR,8bR)-8b-hydroxy-4-oxo-3-phenyl-3aH-indeno[1,2-c]pyrazole-1-carbothioamide CAS Name: (3aR,8bR)-8b-hydroxy-4-oxo-3-phenyl-3aH-indeno[1,2-c]pyrazole-1-carbothioamide IUPAC Name: (3aR,8bR)-8b-hydroxy-4-oxo-3-phenyl-3aH-indeno[1,2-c]pyrazole-1-carbothioamide Traditional Name: (3aR,8bR)-8b-hydroxy-4-keto-3-phenyl-3aH-indeno[1,2-c]pyrazole-1-carbothioamide Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C3(C2C(=O)C4=CC=CC=C43)O)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN([C@]3([C@@H]2C(=O)C4=CC=CC=C43)O)C(=S)N

InChI

InChI=1S/C17H13N3O2S/c18-16(23)20-17(22)12-9-5-4-8-11(12)15(21)13(17)14(19-20)10-6-2-1-3-7-10/h1-9,13,22H,(H2,18,23)/t13-,17-/m0/s1