2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-(3,5-dimethyl-1-pyrazolyl)phenyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]acetamide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC=C2NC(=O)CSCC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC=C2NC(=O)CSCC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H20N4OS2/c1-14-11-15(2)25(24-14)18-9-5-3-7-16(18)22-20(26)12-27-13-21-23-17-8-4-6-10-19(17)28-21/h3-11H,12-13H2,1-2H3,(H,22,26)