2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetamide Formula: C20H18N4OS2 MolecularWeight: 394.51312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H18N4OS2/c1-13-19(14(2)24(23-13)15-8-4-3-5-9-15)22-18(25)12-26-20-21-16-10-6-7-11-17(16)27-20/h3-11H,12H2,1-2H3,(H,22,25)