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

Systemtic Name: (6E)-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]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[6-(1-propan-2-yl-3-indazolyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-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]cyclohexa-2,4-dien-1-one Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4OS/c1-12(2)24-17-9-5-3-8-14(17)19(23-24)16-11-15(21-20(26)22-16)13-7-4-6-10-18(13)25/h3-12H,1-2H3,(H2,21,22,26)/b15-13+