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

Systemtic Name: 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylsulfanylphenyl)ethanamide Openeye Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylsulfanylphenyl)acetamide CAS Name: 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-[2-(phenylthio)phenyl]acetamide IUPAC Name: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylsulfanylphenyl)acetamide Traditional Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[2-(phenylthio)phenyl]acetamide Formula: C21H18N6OS2 MolecularWeight: 434.53722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)CSC3=NN=C(N3N)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)CSC3=NN=C(N3N)C4=CN=CC=C4

InChI

InChI=1S/C21H18N6OS2/c22-27-20(15-7-6-12-23-13-15)25-26-21(27)29-14-19(28)24-17-10-4-5-11-18(17)30-16-8-2-1-3-9-16/h1-13H,14,22H2,(H,24,28)