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

Systemtic Name: (3R)-1-(benzotriazol-1-yl)-3-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)butan-1-one Openeye Name: (3R)-1-(benzotriazol-1-yl)-3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butan-1-one CAS Name: (3R)-1-(1-benzotriazolyl)-3-(4-chloro-3,5-dimethyl-1-pyrazolyl)-1-butanone IUPAC Name: (3R)-1-(benzotriazol-1-yl)-3-(4-chloro-3,5-dimethylpyrazol-1-yl)butan-1-one Traditional Name: (3R)-1-(benzotriazol-1-yl)-3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butan-1-one Formula: C15H16ClN5O MolecularWeight: 317.77344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)CC(=O)N2C3=CC=CC=C3N=N2)C)Cl

Isomeric SMILES

CC1=C(C(=NN1[C@H](C)CC(=O)N2C3=CC=CC=C3N=N2)C)Cl

InChI

InChI=1S/C15H16ClN5O/c1-9(20-11(3)15(16)10(2)18-20)8-14(22)21-13-7-5-4-6-12(13)17-19-21/h4-7,9H,8H2,1-3H3/t9-/m1/s1