2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-N-[(2S)-3-methyl-1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-N-[(2S)-3-methyl-1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl]ethanamide Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-N-[(1S)-2-methyl-1-(pyrrolidine-1-carbonyl)propyl]acetamide CAS Name: 2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)thio]-N-[(2S)-3-methyl-1-oxo-1-(1-pyrrolidinyl)butan-2-yl]acetamide IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfanyl-N-[(2S)-3-methyl-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]acetamide Traditional Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thio]-N-[(1S)-2-methyl-1-(pyrrolidine-1-carbonyl)propyl]acetamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)NC(C(C)C)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)N[C@@H](C(C)C)C(=O)N3CCCC3

InChI

InChI=1S/C22H30N4O2S/c1-15(2)20(22(28)25-12-8-9-13-25)23-19(27)14-29-21-16(3)24-26(17(21)4)18-10-6-5-7-11-18/h5-7,10-11,15,20H,8-9,12-14H2,1-4H3,(H,23,27)/t20-/m0/s1