(E)-3-(1,3-diphenylpyrazol-4-yl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(1,3-diphenyl-4-pyrazolyl)-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-2-propenamide IUPAC Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]acrylamide Formula: C21H17N5OS2 MolecularWeight: 419.52258

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(S1)NC(=O)C=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CSC1=NN=C(S1)NC(=O)/C=C/C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N5OS2/c1-28-21-24-23-20(29-21)22-18(27)13-12-16-14-26(17-10-6-3-7-11-17)25-19(16)15-8-4-2-5-9-15/h2-14H,1H3,(H,22,23,27)/b13-12+