3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl (E)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl (E)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl (E)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-2-propenoic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl (E)-3-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)acrylic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C24H23ClN4O3 MolecularWeight: 450.91742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OCCCN2C3=CC=CC=C3NC2=O)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)OCCCN2C3=CC=CC=C3NC2=O)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H23ClN4O3/c1-17-19(23(25)29(27-17)16-18-8-3-2-4-9-18)12-13-22(30)32-15-7-14-28-21-11-6-5-10-20(21)26-24(28)31/h2-6,8-13H,7,14-16H2,1H3,(H,26,31)/b13-12+