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

Systemtic Name: (E)-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-(5-bromanyl-2-methoxy-phenyl)-N-butyl-prop-2-enamide Openeye Name: (E)-N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-3-(5-bromo-2-methoxy-phenyl)-N-butyl-prop-2-enamide CAS Name: (E)-N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-3-(5-bromo-2-methoxyphenyl)-N-butyl-2-propenamide IUPAC Name: (E)-N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-(5-bromo-2-methoxyphenyl)-N-butylprop-2-enamide Traditional Name: (E)-N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-(5-bromo-2-methoxy-phenyl)-N-butyl-acrylamide Formula: C22H29BrN4O4 MolecularWeight: 493.39406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C=CC2=C(C=CC(=C2)Br)OC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)/C=C/C2=C(C=CC(=C2)Br)OC)N

InChI

InChI=1S/C22H29BrN4O4/c1-4-6-12-26(18(28)11-8-15-14-16(23)9-10-17(15)31-3)19-20(24)27(13-7-5-2)22(30)25-21(19)29/h8-11,14H,4-7,12-13,24H2,1-3H3,(H,25,29,30)/b11-8+