N-(4-chloranyl-3-nitro-phenyl)-2-phenyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-phenyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-phenyl-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-phenyl-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-phenyl-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-phenyl-2-[(1-phenyltetrazol-5-yl)thio]acetamide Formula: C21H15ClN6O3S MolecularWeight: 466.9002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])SC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])SC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C21H15ClN6O3S/c22-17-12-11-15(13-18(17)28(30)31)23-20(29)19(14-7-3-1-4-8-14)32-21-24-25-26-27(21)16-9-5-2-6-10-16/h1-13,19H,(H,23,29)