tert-butyl N-[2-[1,7-dipyridin-3-ylheptan-4-yl(methyl)amino]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[1,7-dipyridin-3-ylheptan-4-yl(methyl)amino]-2-oxidanylidene-ethyl]carbamate Openeye Name: tert-butyl N-[2-[methyl-[4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[2-[1,7-bis(3-pyridinyl)heptan-4-yl-methylamino]-2-oxoethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[1,7-dipyridin-3-ylheptan-4-yl(methyl)amino]-2-oxoethyl]carbamate Traditional Name: N-[2-keto-2-[methyl-[4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl]amino]ethyl]carbamic acid tert-butyl ester Formula: C25H36N4O3 MolecularWeight: 440.57834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)N(C)C(CCCC1=CN=CC=C1)CCCC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)N(C)C(CCCC1=CN=CC=C1)CCCC2=CN=CC=C2

InChI

InChI=1S/C25H36N4O3/c1-25(2,3)32-24(31)28-19-23(30)29(4)22(13-5-9-20-11-7-15-26-17-20)14-6-10-21-12-8-16-27-18-21/h7-8,11-12,15-18,22H,5-6,9-10,13-14,19H2,1-4H3,(H,28,31)