2-bromanyl-N-[6-butyl-5-(4-iodophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]propanamide

Systemtic Name: 2-bromanyl-N-[6-butyl-5-(4-iodophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]propanamide Openeye Name: 2-bromo-N-[6-butyl-5-(4-iodophenyl)-4-oxo-1H-pyrimidin-2-yl]propanamide CAS Name: 2-bromo-N-[6-butyl-5-(4-iodophenyl)-4-oxo-1H-pyrimidin-2-yl]propanamide IUPAC Name: 2-bromo-N-[6-butyl-5-(4-iodophenyl)-4-oxo-1H-pyrimidin-2-yl]propanamide Traditional Name: 2-bromo-N-[6-butyl-5-(4-iodophenyl)-4-keto-1H-pyrimidin-2-yl]propionamide Formula: C17H19BrIN3O2 MolecularWeight: 504.16013

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N=C(N1)NC(=O)C(C)Br)C2=CC=C(C=C2)I

Isomeric SMILES

CCCCC1=C(C(=O)N=C(N1)NC(=O)C(C)Br)C2=CC=C(C=C2)I

InChI

InChI=1S/C17H19BrIN3O2/c1-3-4-5-13-14(11-6-8-12(19)9-7-11)16(24)22-17(20-13)21-15(23)10(2)18/h6-10H,3-5H2,1-2H3,(H2,20,21,22,23,24)