2,6-dimethyl-4-[3-(4-pentylcyclohexyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-dimethyl-4-[3-(4-pentylcyclohexyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-dimethyl-4-[3-(4-pentylcyclohexyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 2,6-dimethyl-4-[3-(4-pentylcyclohexyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-dimethyl-4-[3-(4-pentylcyclohexyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[3-(4-amylcyclohexyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ylidene]-2,6-dimethyl-cyclohexa-2,5-dien-1-one Formula: C23H32N4OS MolecularWeight: 412.59138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=NN=C3N2NC(=C4C=C(C(=O)C(=C4)C)C)CS3

Isomeric SMILES

CCCCCC1CCC(CC1)C2=NN=C3N2NC(=C4C=C(C(=O)C(=C4)C)C)CS3

InChI

InChI=1S/C23H32N4OS/c1-4-5-6-7-17-8-10-18(11-9-17)22-24-25-23-27(22)26-20(14-29-23)19-12-15(2)21(28)16(3)13-19/h12-13,17-18,26H,4-11,14H2,1-3H3