(E)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-3-(3-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-3-(3-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-3-(3-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-3-(3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-3-(3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-3-(3-methoxyphenyl)acrylamide Formula: C21H28N4O4 MolecularWeight: 400.47142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)/C=C/C2=CC(=CC=C2)OC

InChI

InChI=1S/C21H28N4O4/c1-4-6-13-24(17(26)11-10-15-8-7-9-16(14-15)29-3)18-19(22)25(12-5-2)21(28)23-20(18)27/h7-11,14H,4-6,12-13,22H2,1-3H3,(H,23,27,28)/b11-10+