5-nitro-N-[(1-phenylcyclopropyl)methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]benzamide

Systemtic Name: 5-nitro-N-[(1-phenylcyclopropyl)methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]benzamide Openeye Name: 5-nitro-N-[(1-phenylcyclopropyl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-benzamide CAS Name: 5-nitro-N-[(1-phenylcyclopropyl)methyl]-2-[(1-phenyl-5-tetrazolyl)thio]benzamide IUPAC Name: 5-nitro-N-[(1-phenylcyclopropyl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanylbenzamide Traditional Name: 5-nitro-N-[(1-phenylcyclopropyl)methyl]-2-[(1-phenyltetrazol-5-yl)thio]benzamide Formula: C24H20N6O3S MolecularWeight: 472.519

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NN=NN3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC1(CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NN=NN3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H20N6O3S/c31-22(25-16-24(13-14-24)17-7-3-1-4-8-17)20-15-19(30(32)33)11-12-21(20)34-23-26-27-28-29(23)18-9-5-2-6-10-18/h1-12,15H,13-14,16H2,(H,25,31)