tert-butyl N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]carbamate

Systemtic Name: tert-butyl N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]carbamate Openeye Name: tert-butyl N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methyleneamino]carbamate CAS Name: N-[(E)-[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylideneamino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylideneamino]carbamate Traditional Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methyleneamino]carbamic acid tert-butyl ester Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)OC(C)(C)C)N2CCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=O)OC(C)(C)C)N2CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C20H27N5O2/c1-15-17(14-21-22-19(26)27-20(2,3)4)18(24-12-8-9-13-24)25(23-15)16-10-6-5-7-11-16/h5-7,10-11,14H,8-9,12-13H2,1-4H3,(H,22,26)/b21-14+