N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-butyl-4-prop-2-enoxy-benzamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-butyl-4-prop-2-enoxy-benzamide Openeye Name: 4-allyloxy-N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-benzamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-butyl-4-prop-2-enoxybenzamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-butyl-4-prop-2-enoxybenzamide Traditional Name: 4-allyloxy-N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-benzamide Formula: C25H28N4O4 MolecularWeight: 448.51422

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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)C3=CC=C(C=C3)OCC=C

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=CC=C(C=C3)OCC=C

InChI

InChI=1S/C25H28N4O4/c1-3-5-15-28(24(31)19-11-13-20(14-12-19)33-16-4-2)21-22(26)29(25(32)27-23(21)30)17-18-9-7-6-8-10-18/h4,6-14H,2-3,5,15-17,26H2,1H3,(H,27,30,32)