N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C26H18N6OS2 MolecularWeight: 494.59072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C26H18N6OS2/c27-15-18-11-13-19(14-12-18)17-34-26-30-29-25(35-26)28-24(33)22-16-32(21-9-5-2-6-10-21)31-23(22)20-7-3-1-4-8-20/h1-14,16H,17H2,(H,28,29,33)