3-tert-butyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-phenyl-pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-phenyl-pyrazole-4-sulfonamide Openeye Name: 3-tert-butyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-phenyl-pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-1-phenyl-4-pyrazolesulfonamide IUPAC Name: 3-tert-butyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-phenylpyrazole-4-sulfonamide Traditional Name: 3-tert-butyl-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-1-phenyl-pyrazole-4-sulfonamide Formula: C17H21N5O2S3 MolecularWeight: 423.57594

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NS(=O)(=O)C2=CN(N=C2C(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CCSC1=NN=C(S1)NS(=O)(=O)C2=CN(N=C2C(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C17H21N5O2S3/c1-5-25-16-19-18-15(26-16)21-27(23,24)13-11-22(12-9-7-6-8-10-12)20-14(13)17(2,3)4/h6-11H,5H2,1-4H3,(H,18,21)