4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-5-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxidanylidene-pyran-3-carbonitrile

Systemtic Name: 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-5-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxidanylidene-pyran-3-carbonitrile Openeye Name: 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-5-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-oxo-pyran-3-carbonitrile CAS Name: 4-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-5-[2,5-dimethyl-1-(2-thiazolyl)-3-pyrrolyl]-2-oxo-3-pyrancarbonitrile IUPAC Name: 4-(3,5-dimethyl-1-phenylpyrazol-4-yl)-5-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxopyran-3-carbonitrile Traditional Name: 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-5-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-keto-pyran-3-carbonitrile Formula: C26H21N5O2S MolecularWeight: 467.54224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NC=CS2)C)C3=COC(=O)C(=C3C4=C(N(N=C4C)C5=CC=CC=C5)C)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=NC=CS2)C)C3=COC(=O)C(=C3C4=C(N(N=C4C)C5=CC=CC=C5)C)C#N

InChI

InChI=1S/C26H21N5O2S/c1-15-12-20(17(3)30(15)26-28-10-11-34-26)22-14-33-25(32)21(13-27)24(22)23-16(2)29-31(18(23)4)19-8-6-5-7-9-19/h5-12,14H,1-4H3