N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-2-(azocan-1-yl)-N-butyl-ethanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-2-(azocan-1-yl)-N-butyl-ethanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-2-(azocan-1-yl)-N-butyl-acetamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-2-(1-azocanyl)-N-butylacetamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-2-(azocan-1-yl)-N-butylacetamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-2-(azocan-1-yl)-N-butyl-acetamide Formula: C24H35N5O3 MolecularWeight: 441.5664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CN3CCCCCCC3

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CN3CCCCCCC3

InChI

InChI=1S/C24H35N5O3/c1-2-3-16-28(20(30)18-27-14-10-5-4-6-11-15-27)21-22(25)29(24(32)26-23(21)31)17-19-12-8-7-9-13-19/h7-9,12-13H,2-6,10-11,14-18,25H2,1H3,(H,26,31,32)