5-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(1,3-diphenyl-4-pyrazolyl)methylthio]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(1,3-diphenylpyrazol-4-yl)methylthio]-1,3,4-thiadiazol-2-yl]-(2-methoxyethyl)amine Formula: C21H21N5OS2 MolecularWeight: 423.55434

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NN=C(S1)SCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COCCNC1=NN=C(S1)SCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5OS2/c1-27-13-12-22-20-23-24-21(29-20)28-15-17-14-26(18-10-6-3-7-11-18)25-19(17)16-8-4-2-5-9-16/h2-11,14H,12-13,15H2,1H3,(H,22,23)