(E)-N-(1H-benzimidazol-2-yl)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-N-(1H-benzimidazol-2-yl)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-N-(1H-benzimidazol-2-yl)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-(1H-benzimidazol-2-yl)-3-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-(1H-benzimidazol-2-yl)-3-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(1H-benzimidazol-2-yl)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)acrylamide Formula: C21H18ClN5O MolecularWeight: 391.85352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NC2=NC3=CC=CC=C3N2)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NC2=NC3=CC=CC=C3N2)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H18ClN5O/c1-14-16(20(22)27(26-14)13-15-7-3-2-4-8-15)11-12-19(28)25-21-23-17-9-5-6-10-18(17)24-21/h2-12H,13H2,1H3,(H2,23,24,25,28)/b12-11+