N-[2-(4-chloranyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-(4-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-chloranyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-(4-methylphenyl)sulfanyl-ethanamide Openeye Name: N-[2-(4-chloro-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-(p-tolylsulfanyl)acetamide CAS Name: N-[2-(4-chloro-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-2-[(4-methylphenyl)thio]acetamide IUPAC Name: N-[2-(4-chloro-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-2-(4-methylphenyl)sulfanylacetamide Traditional Name: N-[2-(4-chloro-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-(p-tolylthio)acetamide Formula: C20H17ClN4OS2 MolecularWeight: 428.95818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=CC(=NN2C3=NC4=C(S3)C=CC=C4Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=CC(=NN2C3=NC4=C(S3)C=CC=C4Cl)C

InChI

InChI=1S/C20H17ClN4OS2/c1-12-6-8-14(9-7-12)27-11-18(26)22-17-10-13(2)24-25(17)20-23-19-15(21)4-3-5-16(19)28-20/h3-10H,11H2,1-2H3,(H,22,26)