3-[4-methyl-5-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-methyl-5-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-methyl-5-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[(4-oxo-1,2,3-benzotriazin-3-yl)methylthio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(4-keto-1,2,3-benzotriazin-3-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C14H15N7O2S MolecularWeight: 345.3796

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCN2C(=O)C3=CC=CC=C3N=N2)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SCN2C(=O)C3=CC=CC=C3N=N2)CCC(=O)N

InChI

InChI=1S/C14H15N7O2S/c1-20-12(7-6-11(15)22)17-18-14(20)24-8-21-13(23)9-4-2-3-5-10(9)16-19-21/h2-5H,6-8H2,1H3,(H2,15,22)