N-[4-(3,4-dimethoxyphenyl)-5-methyl-2-phenyl-pyrazol-3-yl]-1-(1,2,3-thiadiazol-5-yl)methanimine

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-5-methyl-2-phenyl-pyrazol-3-yl]-1-(1,2,3-thiadiazol-5-yl)methanimine Openeye Name: N-[4-(3,4-dimethoxyphenyl)-5-methyl-2-phenyl-pyrazol-3-yl]-1-(thiadiazol-5-yl)methanimine CAS Name: N-[4-(3,4-dimethoxyphenyl)-5-methyl-2-phenyl-3-pyrazolyl]-1-(5-thiadiazolyl)methanimine IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-5-methyl-2-phenylpyrazol-3-yl]-1-(thiadiazol-5-yl)methanimine Traditional Name: (E)-[4-(3,4-dimethoxyphenyl)-5-methyl-2-phenyl-pyrazol-3-yl]-(thiadiazol-5-ylmethylene)amine Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC(=C(C=C2)OC)OC)N=CC3=CN=NS3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C2=CC(=C(C=C2)OC)OC)/N=C/C3=CN=NS3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N5O2S/c1-14-20(15-9-10-18(27-2)19(11-15)28-3)21(22-12-17-13-23-25-29-17)26(24-14)16-7-5-4-6-8-16/h4-13H,1-3H3/b22-12+