8-methoxy-5-methylsulfanyl-1H-[1,2,3]triazolo[1,5-a][1,3,5]benzotriazepine-3-carboxamide

Systemtic Name: 8-methoxy-5-methylsulfanyl-1H-[1,2,3]triazolo[1,5-a][1,3,5]benzotriazepine-3-carboxamide Openeye Name: 8-methoxy-5-methylsulfanyl-1H-triazolo[1,5-a][1,3,5]benzotriazepine-3-carboxamide CAS Name: 8-methoxy-5-(methylthio)-1H-triazolo[1,5-a][1,3,5]benzotriazepine-3-carboxamide IUPAC Name: 8-methoxy-5-methylsulfanyl-1H-triazolo[1,5-a][1,3,5]benzotriazepine-3-carboxamide Traditional Name: 8-methoxy-5-(methylthio)-1H-triazolo[1,5-a][1,3,5]benzotriazepine-3-carboxamide Formula: C12H12N6O2S MolecularWeight: 304.32768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N3C(=NC(=N2)SC)C(=NN3)C(=O)N

Isomeric SMILES

COC1=CC2=C(C=C1)N3C(=NC(=N2)SC)C(=NN3)C(=O)N

InChI

InChI=1S/C12H12N6O2S/c1-20-6-3-4-8-7(5-6)14-12(21-2)15-11-9(10(13)19)16-17-18(8)11/h3-5,17H,1-2H3,(H2,13,19)