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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-(3-bromanyl-4-methoxy-phenyl)-N-butyl-propanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-3-(3-bromo-4-methoxy-phenyl)-N-butyl-propanamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-3-(3-bromo-4-methoxyphenyl)-N-butylpropanamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-(3-bromo-4-methoxyphenyl)-N-butylpropanamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-(3-bromo-4-methoxy-phenyl)-N-butyl-propionamide Formula: C22H31BrN4O4 MolecularWeight: 495.40994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)CCC2=CC(=C(C=C2)OC)Br)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)CCC2=CC(=C(C=C2)OC)Br)N

InChI

InChI=1S/C22H31BrN4O4/c1-4-6-12-26(18(28)11-9-15-8-10-17(31-3)16(23)14-15)19-20(24)27(13-7-5-2)22(30)25-21(19)29/h8,10,14H,4-7,9,11-13,24H2,1-3H3,(H,25,29,30)