(2E)-2-[4-(2-methoxy-2,3-dihydro-1H-inden-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-5-oxidanyl-6-propan-2-yl-pyridin-3-one

Systemtic Name: (2E)-2-[4-(2-methoxy-2,3-dihydro-1H-inden-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-5-oxidanyl-6-propan-2-yl-pyridin-3-one Openeye Name: (2E)-5-hydroxy-6-isopropyl-2-[4-(2-methoxyindan-5-yl)-5-thioxo-1,2,4-triazolidin-3-ylidene]pyridin-3-one CAS Name: (2E)-5-hydroxy-2-[4-(2-methoxy-2,3-dihydro-1H-inden-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-6-propan-2-yl-3-pyridinone IUPAC Name: (2E)-5-hydroxy-2-[4-(2-methoxy-2,3-dihydro-1H-inden-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-6-propan-2-ylpyridin-3-one Traditional Name: (2E)-5-hydroxy-6-isopropyl-2-[4-(2-methoxyindan-5-yl)-5-thioxo-1,2,4-triazolidin-3-ylidene]pyridin-3-one Formula: C20H22N4O3S MolecularWeight: 398.47868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=C2NNC(=S)N2C3=CC4=C(CC(C4)OC)C=C3)C(=O)C=C1O

Isomeric SMILES

CC(C)C1=N/C(=C\2/NNC(=S)N2C3=CC4=C(CC(C4)OC)C=C3)/C(=O)C=C1O

InChI

InChI=1S/C20H22N4O3S/c1-10(2)17-15(25)9-16(26)18(21-17)19-22-23-20(28)24(19)13-5-4-11-7-14(27-3)8-12(11)6-13/h4-6,9-10,14,22,25H,7-8H2,1-3H3,(H,23,28)/b19-18-