(2S)-N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-2-chloranyl-2-phenyl-ethanamide

Systemtic Name: (2S)-N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-2-chloranyl-2-phenyl-ethanamide Openeye Name: (2S)-N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-oxo-ethyl]-2-chloro-2-phenyl-acetamide CAS Name: (2S)-N-butyl-N-[2-[(5-tert-butyl-2-methyl-3-pyrazolyl)amino]-2-oxoethyl]-2-chloro-2-phenylacetamide IUPAC Name: (2S)-N-butyl-N-[2-[(5-tert-butyl-2-methylpyrazol-3-yl)amino]-2-oxoethyl]-2-chloro-2-phenylacetamide Traditional Name: (2S)-N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-keto-ethyl]-2-chloro-2-phenyl-acetamide Formula: C22H31ClN4O2 MolecularWeight: 418.96014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C)C(C)(C)C)C(=O)C(C2=CC=CC=C2)Cl

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C)C(C)(C)C)C(=O)[C@H](C2=CC=CC=C2)Cl

InChI

InChI=1S/C22H31ClN4O2/c1-6-7-13-27(21(29)20(23)16-11-9-8-10-12-16)15-19(28)24-18-14-17(22(2,3)4)25-26(18)5/h8-12,14,20H,6-7,13,15H2,1-5H3,(H,24,28)/t20-/m0/s1