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

Systemtic Name: 3-[5-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-isobutyl-5-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(7-methoxy-2-oxochromen-4-yl)methylsulfanyl]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-isobutyl-5-[(2-keto-7-methoxy-chromen-4-yl)methylthio]-1,2,4-triazol-3-yl]propionamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O4S/c1-12(2)10-24-18(7-6-17(21)25)22-23-20(24)29-11-13-8-19(26)28-16-9-14(27-3)4-5-15(13)16/h4-5,8-9,12H,6-7,10-11H2,1-3H3,(H2,21,25)