2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-thiadiazole

Systemtic Name: 2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-thiadiazole Openeye Name: 2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-thiadiazole CAS Name: 2-[[4-(1-pyrazolyl)phenyl]methylthio]-1,3,4-thiadiazole IUPAC Name: 2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-thiadiazole Traditional Name: 2-[(4-pyrazol-1-ylbenzyl)thio]-1,3,4-thiadiazole Formula: C12H10N4S2 MolecularWeight: 274.3646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)CSC3=NN=CS3

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)CSC3=NN=CS3

InChI

InChI=1S/C12H10N4S2/c1-6-14-16(7-1)11-4-2-10(3-5-11)8-17-12-15-13-9-18-12/h1-7,9H,8H2