N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(3-chlorophenyl)-5-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(3-chlorophenyl)-5-methyl-pyrazole-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(3-chlorophenyl)-5-methyl-pyrazole-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(3-chlorophenyl)-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(3-chlorophenyl)-5-methylpyrazole-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(3-chlorophenyl)-5-methyl-pyrazole-4-carboxamide Formula: C21H19ClN4OS MolecularWeight: 410.91976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19ClN4OS/c1-14-17(13-24-26(14)16-7-4-6-15(22)12-16)21(27)23-11-5-10-20-25-18-8-2-3-9-19(18)28-20/h2-4,6-9,12-13H,5,10-11H2,1H3,(H,23,27)