5-chloranyl-3-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-1-phenyl-pyrazole-4-carboxamide Formula: C19H15ClN4OS2 MolecularWeight: 414.9316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SC)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SC)Cl)C4=CC=CC=C4

InChI

InChI=1S/C19H15ClN4OS2/c1-11-16(17(20)24(23-11)13-6-4-3-5-7-13)18(25)21-12-8-9-14-15(10-12)27-19(22-14)26-2/h3-10H,1-2H3,(H,21,25)