[4-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-3-nitro-phenyl]-phenyl-methanone Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H24N4O3S/c1-26(2,3)20-13-10-18(11-14-20)24-27-28-25(29(24)4)34-22-15-12-19(16-21(22)30(32)33)23(31)17-8-6-5-7-9-17/h5-16H,1-4H3