tert-butyl N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-pyridin-3-ylcarbonyl-carbamate

Systemtic Name: tert-butyl N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-pyridin-3-ylcarbonyl-carbamate Openeye Name: tert-butyl N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-(pyridine-3-carbonyl)carbamate CAS Name: N-[3-[(2,5-dimethyl-3-pyrazolyl)methylamino]propyl]-N-[oxo(3-pyridinyl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-(pyridine-3-carbonyl)carbamate Traditional Name: N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-nicotinoyl-carbamic acid tert-butyl ester Formula: C20H29N5O3 MolecularWeight: 387.47596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CNCCCN(C(=O)C2=CN=CC=C2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=NN(C(=C1)CNCCCN(C(=O)C2=CN=CC=C2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C20H29N5O3/c1-15-12-17(24(5)23-15)14-22-10-7-11-25(19(27)28-20(2,3)4)18(26)16-8-6-9-21-13-16/h6,8-9,12-13,22H,7,10-11,14H2,1-5H3