(6E)-4-bromanyl-6-[6-(1-propan-2-ylindazol-3-yl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-4-bromanyl-6-[6-(1-propan-2-ylindazol-3-yl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-bromo-6-[6-(1-isopropylindazol-3-yl)-2-thioxo-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-bromo-6-[6-(1-propan-2-yl-3-indazolyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-bromo-6-[6-(1-propan-2-ylindazol-3-yl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-bromo-6-[6-(1-isopropylindazol-3-yl)-2-thioxo-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Formula: C20H17BrN4OS MolecularWeight: 441.34418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2C(=N1)C3=CC(=C4C=C(C=CC4=O)Br)NC(=S)N3

Isomeric SMILES

CC(C)N1C2=CC=CC=C2C(=N1)C3=C/C(=C\4/C=C(C=CC4=O)Br)/NC(=S)N3

InChI

InChI=1S/C20H17BrN4OS/c1-11(2)25-17-6-4-3-5-13(17)19(24-25)16-10-15(22-20(27)23-16)14-9-12(21)7-8-18(14)26/h3-11H,1-2H3,(H2,22,23,27)/b15-14+