5-nitro-N-(6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)-2-phenylsulfanyl-benzamide

Systemtic Name: 5-nitro-N-(6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)-2-phenylsulfanyl-benzamide Openeye Name: 5-nitro-N-(6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)-2-phenylsulfanyl-benzamide CAS Name: 5-nitro-N-(6-phenyl-2-imidazo[2,1-b][1,3,4]thiadiazolyl)-2-(phenylthio)benzamide IUPAC Name: 5-nitro-N-(6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)-2-phenylsulfanylbenzamide Traditional Name: 5-nitro-N-(6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)-2-(phenylthio)benzamide Formula: C23H15N5O3S2 MolecularWeight: 473.5269

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN3C(=N2)SC(=N3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])SC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CN3C(=N2)SC(=N3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])SC5=CC=CC=C5

InChI

InChI=1S/C23H15N5O3S2/c29-21(18-13-16(28(30)31)11-12-20(18)32-17-9-5-2-6-10-17)25-22-26-27-14-19(24-23(27)33-22)15-7-3-1-4-8-15/h1-14H,(H,25,26,29)