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

Systemtic Name: (6E)-4-methyl-6-[6-(1-propan-2-ylindazol-3-yl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[6-(1-isopropylindazol-3-yl)-2-thioxo-1H-pyrimidin-4-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-methyl-6-[6-(1-propan-2-yl-3-indazolyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-methyl-6-[6-(1-propan-2-ylindazol-3-yl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[6-(1-isopropylindazol-3-yl)-2-thioxo-1H-pyrimidin-4-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC(=S)N2)C3=NN(C4=CC=CC=C43)C(C)C)C(=O)C=C1

Isomeric SMILES

CC1=C/C(=C\2/C=C(NC(=S)N2)C3=NN(C4=CC=CC=C43)C(C)C)/C(=O)C=C1

InChI

InChI=1S/C21H20N4OS/c1-12(2)25-18-7-5-4-6-14(18)20(24-25)17-11-16(22-21(27)23-17)15-10-13(3)8-9-19(15)26/h4-12H,1-3H3,(H2,22,23,27)/b16-15+