(3R)-1-(benzimidazol-1-yl)-3-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)butan-1-one

Systemtic Name: (3R)-1-(benzimidazol-1-yl)-3-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)butan-1-one Openeye Name: (3R)-1-(benzimidazol-1-yl)-3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butan-1-one CAS Name: (3R)-1-(1-benzimidazolyl)-3-(4-chloro-3,5-dimethyl-1-pyrazolyl)-1-butanone IUPAC Name: (3R)-1-(benzimidazol-1-yl)-3-(4-chloro-3,5-dimethylpyrazol-1-yl)butan-1-one Traditional Name: (3R)-1-(benzimidazol-1-yl)-3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butan-1-one Formula: C16H17ClN4O MolecularWeight: 316.78538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)CC(=O)N2C=NC3=CC=CC=C32)C)Cl

Isomeric SMILES

CC1=C(C(=NN1[C@H](C)CC(=O)N2C=NC3=CC=CC=C32)C)Cl

InChI

InChI=1S/C16H17ClN4O/c1-10(21-12(3)16(17)11(2)19-21)8-15(22)20-9-18-13-6-4-5-7-14(13)20/h4-7,9-10H,8H2,1-3H3/t10-/m1/s1