2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenyldiazenylphenyl)ethanamide

Systemtic Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenyldiazenylphenyl)ethanamide Openeye Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenylazophenyl)acetamide CAS Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-(4-phenyldiazenylphenyl)acetamide IUPAC Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenyldiazenylphenyl)acetamide Traditional Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-(4-phenylazophenyl)acetamide Formula: C22H22N6OS MolecularWeight: 418.51468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC(=O)NC4=CC=C(C=C4)N=NC5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC(=O)NC4=CC=C(C=C4)N=NC5=CC=CC=C5

InChI

InChI=1S/C22H22N6OS/c29-20(14-30-22-27-26-21(15-6-7-15)28(22)19-12-13-19)23-16-8-10-18(11-9-16)25-24-17-4-2-1-3-5-17/h1-5,8-11,15,19H,6-7,12-14H2,(H,23,29)