4-bromanyl-6-[4-(2,4-dimethylphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-6-[4-(2,4-dimethylphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[4-(2,4-dimethylphenyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[4-(2,4-dimethylphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[4-(2,4-dimethylphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[4-(2,4-dimethylphenyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C16H14BrN3OS MolecularWeight: 376.27086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C3C=C(C=CC3=O)Br)NNC2=S)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C3C=C(C=CC3=O)Br)NNC2=S)C

InChI

InChI=1S/C16H14BrN3OS/c1-9-3-5-13(10(2)7-9)20-15(18-19-16(20)22)12-8-11(17)4-6-14(12)21/h3-8,18H,1-2H3,(H,19,22)