4-[[5-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[5-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[5-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[5-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[5-(2,5-dimethyl-1-phenylpyrrol-3-yl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[5-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C26H26N6OS MolecularWeight: 470.58924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C3=NN=C(SC3)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C3=NN=C(SC3)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C

InChI

InChI=1S/C26H26N6OS/c1-17-15-22(18(2)31(17)20-11-7-5-8-12-20)23-16-34-26(29-28-23)27-24-19(3)30(4)32(25(24)33)21-13-9-6-10-14-21/h5-15H,16H2,1-4H3,(H,27,29)