3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide CAS Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]-N-(1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(1,3,4-thiadiazol-2-yl)acrylamide Formula: C22H19N5O3S MolecularWeight: 433.48296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)NC3=NN=CS3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)NC3=NN=CS3)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H19N5O3S/c1-29-18-10-8-15(12-19(18)30-2)21-16(9-11-20(28)24-22-25-23-14-31-22)13-27(26-21)17-6-4-3-5-7-17/h3-14H,1-2H3,(H,24,25,28)