tert-butyl N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-pyridin-4-ylcarbonyl-carbamate

Systemtic Name: tert-butyl N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-pyridin-4-ylcarbonyl-carbamate Openeye Name: tert-butyl N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-(pyridine-4-carbonyl)carbamate CAS Name: N-[3-[(2,5-dimethyl-3-pyrazolyl)methylamino]propyl]-N-[oxo(pyridin-4-yl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-(pyridine-4-carbonyl)carbamate Traditional Name: N-[3-[(2,5-dimethylpyrazol-3-yl)methylamino]propyl]-N-isonicotinoyl-carbamic acid tert-butyl ester Formula: C20H29N5O3 MolecularWeight: 387.47596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N5O3/c1-15-13-17(24(5)23-15)14-22-9-6-12-25(19(27)28-20(2,3)4)18(26)16-7-10-21-11-8-16/h7-8,10-11,13,22H,6,9,12,14H2,1-5H3