4-[[[3-(2-cyclohexylethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-ethoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[[3-(2-cyclohexylethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-ethoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[[3-(2-cyclohexylethyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]-2-ethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[[3-(2-cyclohexylethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-ethoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[[3-(2-cyclohexylethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-ethoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[[3-(2-cyclohexylethyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]-2-ethoxy-cyclohexa-2,5-dien-1-one Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNN2C(=NNC2=S)CCC3CCCCC3)C=CC1=O

Isomeric SMILES

CCOC1=CC(=CNN2C(=NNC2=S)CCC3CCCCC3)C=CC1=O

InChI

InChI=1S/C19H26N4O2S/c1-2-25-17-12-15(8-10-16(17)24)13-20-23-18(21-22-19(23)26)11-9-14-6-4-3-5-7-14/h8,10,12-14,20H,2-7,9,11H2,1H3,(H,22,26)