N-(4-methyl-2-nitro-phenyl)-2-phenyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-2-phenyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-methyl-2-nitro-phenyl)-2-phenyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-methyl-2-nitrophenyl)-2-phenyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-2-phenyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-methyl-2-nitro-phenyl)-2-phenyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C23H19N5O3S MolecularWeight: 445.49366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NNC(=N3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NNC(=N3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O3S/c1-15-12-13-18(19(14-15)28(30)31)24-22(29)20(16-8-4-2-5-9-16)32-23-25-21(26-27-23)17-10-6-3-7-11-17/h2-14,20H,1H3,(H,24,29)(H,25,26,27)