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

Systemtic Name: (6E)-4-bromanyl-6-[[(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-bromo-6-[[(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-bromo-6-[[(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-bromo-6-[[(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-bromo-6-[[(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C12H13BrN4OS MolecularWeight: 341.22682

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1NC=C2C=C(C=CC2=O)Br

Isomeric SMILES

CCCC1=NNC(=S)N1N/C=C/2\C=C(C=CC2=O)Br

InChI

InChI=1S/C12H13BrN4OS/c1-2-3-11-15-16-12(19)17(11)14-7-8-6-9(13)4-5-10(8)18/h4-7,14H,2-3H2,1H3,(H,16,19)/b8-7+