3-[5-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(7-methoxy-2-oxochromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(2-keto-7-methoxy-chromen-4-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C17H18N4O4S MolecularWeight: 374.41422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)OC)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)OC)CCC(=O)N

InChI

InChI=1S/C17H18N4O4S/c1-21-15(6-5-14(18)22)19-20-17(21)26-9-10-7-16(23)25-13-8-11(24-2)3-4-12(10)13/h3-4,7-8H,5-6,9H2,1-2H3,(H2,18,22)