tert-butyl N-[3-(4-pyridin-3-ylimidazol-1-yl)butylamino]carbamate

Systemtic Name: tert-butyl N-[3-(4-pyridin-3-ylimidazol-1-yl)butylamino]carbamate Openeye Name: tert-butyl N-[3-[4-(3-pyridyl)imidazol-1-yl]butylamino]carbamate CAS Name: N-[3-[4-(3-pyridinyl)-1-imidazolyl]butylamino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(4-pyridin-3-ylimidazol-1-yl)butylamino]carbamate Traditional Name: N-[3-[4-(3-pyridyl)imidazol-1-yl]butylamino]carbamic acid tert-butyl ester Formula: C17H25N5O2 MolecularWeight: 331.4127

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNNC(=O)OC(C)(C)C)N1C=C(N=C1)C2=CN=CC=C2

Isomeric SMILES

CC(CCNNC(=O)OC(C)(C)C)N1C=C(N=C1)C2=CN=CC=C2

InChI

InChI=1S/C17H25N5O2/c1-13(7-9-20-21-16(23)24-17(2,3)4)22-11-15(19-12-22)14-6-5-8-18-10-14/h5-6,8,10-13,20H,7,9H2,1-4H3,(H,21,23)