6-nitro-3-[(2S)-1,3-oxathiolan-2-yl]-1-phenyl-4-phenylsulfanyl-indazole

Systemtic Name: 6-nitro-3-[(2S)-1,3-oxathiolan-2-yl]-1-phenyl-4-phenylsulfanyl-indazole Openeye Name: 6-nitro-3-[(2S)-1,3-oxathiolan-2-yl]-1-phenyl-4-phenylsulfanyl-indazole CAS Name: 6-nitro-3-[(2S)-1,3-oxathiolan-2-yl]-1-phenyl-4-(phenylthio)indazole IUPAC Name: 6-nitro-3-[(2S)-1,3-oxathiolan-2-yl]-1-phenyl-4-phenylsulfanylindazole Traditional Name: 6-nitro-3-[(2S)-1,3-oxathiolan-2-yl]-1-phenyl-4-(phenylthio)indazole Formula: C22H17N3O3S2 MolecularWeight: 435.51868

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(O1)C2=NN(C3=CC(=CC(=C32)SC4=CC=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1CS[C@H](O1)C2=NN(C3=CC(=CC(=C32)SC4=CC=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C22H17N3O3S2/c26-25(27)16-13-18-20(19(14-16)30-17-9-5-2-6-10-17)21(22-28-11-12-29-22)23-24(18)15-7-3-1-4-8-15/h1-10,13-14,22H,11-12H2/t22-/m0/s1