5-chloranyl-3-methyl-N-[(2S)-5-methylhexan-2-yl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-[(2S)-5-methylhexan-2-yl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-N-[(1S)-1,4-dimethylpentyl]-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[(2S)-5-methylhexan-2-yl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-[(2S)-5-methylhexan-2-yl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-N-[(1S)-1,4-dimethylpentyl]-3-methyl-pyrazole-4-carboxamide Formula: C19H26ClN3O MolecularWeight: 347.88224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC(C)CCC(C)C)Cl)CC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)N[C@@H](C)CCC(C)C)Cl)CC2=CC=CC=C2

InChI

InChI=1S/C19H26ClN3O/c1-13(2)10-11-14(3)21-19(24)17-15(4)22-23(18(17)20)12-16-8-6-5-7-9-16/h5-9,13-14H,10-12H2,1-4H3,(H,21,24)/t14-/m0/s1