3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-3-phenyldiazenyl-pentane-2,4-dione

Systemtic Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-3-phenyldiazenyl-pentane-2,4-dione Openeye Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-3-phenylazo-pentane-2,4-dione CAS Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-3-phenyldiazenylpentane-2,4-dione IUPAC Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-3-phenyldiazenylpentane-2,4-dione Traditional Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-3-phenylazo-pentane-2,4-dione Formula: C25H21N5O2S MolecularWeight: 455.53154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)(N=NC1=CC=CC=C1)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C(C(=O)C)(N=NC1=CC=CC=C1)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21N5O2S/c1-18(31)25(19(2)32,29-26-21-14-8-4-9-15-21)33-24-28-27-23(20-12-6-3-7-13-20)30(24)22-16-10-5-11-17-22/h3-17H,1-2H3