(6Z)-4-ethyl-3-oxidanyl-6-[4-(1-propylindol-4-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-4-ethyl-3-oxidanyl-6-[4-(1-propylindol-4-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-ethyl-3-hydroxy-6-[4-(1-propylindol-4-yl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-ethyl-3-hydroxy-6-[4-(1-propyl-4-indolyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-ethyl-3-hydroxy-6-[4-(1-propylindol-4-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-4-ethyl-3-hydroxy-6-[4-(1-propylindol-4-yl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CC2=C1C=CC=C2N3C(=C4C=C(C(=CC4=O)O)CC)NNC3=S

Isomeric SMILES

CCCN1C=CC2=C1C=CC=C2N3/C(=C/4\C=C(C(=CC4=O)O)CC)/NNC3=S

InChI

InChI=1S/C21H22N4O2S/c1-3-9-24-10-8-14-16(24)6-5-7-17(14)25-20(22-23-21(25)28)15-11-13(4-2)18(26)12-19(15)27/h5-8,10-12,22,26H,3-4,9H2,1-2H3,(H,23,28)/b20-15+