(4E)-2-bromanyl-6-methoxy-4-[[(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-bromanyl-6-methoxy-4-[[(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-bromo-6-methoxy-4-[[(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-bromo-6-methoxy-4-[[(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-bromo-6-methoxy-4-[[(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-bromo-6-methoxy-4-[[(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C13H15BrN4O2S MolecularWeight: 371.2528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1NC=C2C=C(C(=O)C(=C2)Br)OC

Isomeric SMILES

CCCC1=NNC(=S)N1N/C=C/2\C=C(C(=O)C(=C2)Br)OC

InChI

InChI=1S/C13H15BrN4O2S/c1-3-4-11-16-17-13(21)18(11)15-7-8-5-9(14)12(19)10(6-8)20-2/h5-7,15H,3-4H2,1-2H3,(H,17,21)/b8-7-