N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-5-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H23N5OS/c1-15-17(14-23-27(15)16-8-4-3-5-9-16)22(28)26-20(12-13-29-2)21-24-18-10-6-7-11-19(18)25-21/h3-11,14,20H,12-13H2,1-2H3,(H,24,25)(H,26,28)