ethyl N-[5,6-bis(azanyl)-4-(3-oxidanylheptan-2-ylamino)pyridin-2-yl]carbamate

Systemtic Name: ethyl N-[5,6-bis(azanyl)-4-(3-oxidanylheptan-2-ylamino)pyridin-2-yl]carbamate Openeye Name: ethyl N-[5,6-diamino-4-[(2-hydroxy-1-methyl-hexyl)amino]-2-pyridyl]carbamate CAS Name: N-[5,6-diamino-4-(3-hydroxyheptan-2-ylamino)-2-pyridinyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[5,6-diamino-4-(3-hydroxyheptan-2-ylamino)pyridin-2-yl]carbamate Traditional Name: N-[5,6-diamino-4-[(2-hydroxy-1-methyl-hexyl)amino]-2-pyridyl]carbamic acid ethyl ester Formula: C15H27N5O3 MolecularWeight: 325.40658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)NC1=CC(=NC(=C1N)N)NC(=O)OCC)O

Isomeric SMILES

CCCCC(C(C)NC1=CC(=NC(=C1N)N)NC(=O)OCC)O

InChI

InChI=1S/C15H27N5O3/c1-4-6-7-11(21)9(3)18-10-8-12(19-14(17)13(10)16)20-15(22)23-5-2/h8-9,11,21H,4-7,16H2,1-3H3,(H4,17,18,19,20,22)