2-[[4-azanyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylsulfanylphenyl)ethanamide

Systemtic Name: 2-[[4-azanyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylsulfanylphenyl)ethanamide Openeye Name: 2-[[4-amino-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylsulfanylphenyl)acetamide CAS Name: 2-[[4-amino-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-[2-(phenylthio)phenyl]acetamide IUPAC Name: 2-[[4-amino-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylsulfanylphenyl)acetamide Traditional Name: 2-[[4-amino-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-[2-(phenylthio)phenyl]acetamide Formula: C23H21N5OS2 MolecularWeight: 447.57574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2N)SCC(=O)NC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2N)SCC(=O)NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C23H21N5OS2/c1-16-9-5-6-12-18(16)22-26-27-23(28(22)24)30-15-21(29)25-19-13-7-8-14-20(19)31-17-10-3-2-4-11-17/h2-14H,15,24H2,1H3,(H,25,29)